3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride

C38H49ClN10O7 — CID 158109157

IUPAC3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride
SMILESCNC.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)N(C)C)cc23)CC1.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)O)cc23)CC1.Cl
InChIInChI=1S/C19H23N5O3.C17H18N4O4.C2H7N.ClH/c1-19(27-4)5-7-24(8-6-19)16-12-9-14(18(26)23(2)3)21-11-15(12)22-17(25)13(16)10-20;1-17(25-2)3-5-21(6-4-17)14-10-7-12(16(23)24)19-9-13(10)20-15(22)11(14)8-18;1-3-2;/h9,11H,5-8H2,1-4H3,(H,22,25);7,9H,3-6H2,1-2H3,(H,20,22)(H,23,24);3H,1-2H3;1H
InChIKeyBRZFEEDKSNDGJI-UHFFFAOYSA-N
MW793.33 g/mol
LogP3.26
Rot. Bonds6

About 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride

3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride (PubChem CID 158109157) has the molecular formula C38H49ClN10O7 and a molecular weight of 793.33 g/mol. Its IUPAC name is 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride.

Molecular Properties

Compound Name3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride
PubChem CID158109157
Molecular FormulaC38H49ClN10O7
Molecular Weight793.33 g/mol
Exact Mass792.35
IUPAC Name3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride
SMILESCNC.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)N(C)C)cc23)CC1.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)O)cc23)CC1.Cl
InChIInChI=1S/C19H23N5O3.C17H18N4O4.C2H7N.ClH/c1-19(27-4)5-7-24(8-6-19)16-12-9-14(18(26)23(2)3)21-11-15(12)22-17(25)13(16)10-20;1-17(25-2)3-5-21(6-4-17)14-10-7-12(16(23)24)19-9-13(10)20-15(22)11(14)8-18;1-3-2;/h9,11H,5-8H2,1-4H3,(H,22,25);7,9H,3-6H2,1-2H3,(H,20,22)(H,23,24);3H,1-2H3;1H
InChIKeyBRZFEEDKSNDGJI-UHFFFAOYSA-N
XLogP3.26
TPSA233.66 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500793.33
LogP ≤ 53.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Analyze 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-aminopyridine-2-carboxylic acid;(5-amino-2-pyridinyl)-[4-(dimethylamino)piperidin-1-yl]methanone;N,N-dimethylpiperidin-4-amine;1,1,1,4,4,4-hexafluorobutane-2,3-dione
CID 161736504
3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N-(1-methylazetidin-3-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;1-methylazetidin-3-amine;2,2,2-trifluoroacetic acid
CID 164993416
3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N-[(1-methylpiperidin-4-yl)methyl]-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;(1-methylpiperidin-4-yl)methanamine;2,2,2-trifluoroacetic acid
CID 165014595
5-[4-[(7-ethyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]piperazin-1-yl]-6-fluoropyridine-2-carboxylic acid
CID 178132043
6-[[1-[(4-Cyanophenyl)methyl]piperidin-4-yl]-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]carbamoyl]pyridine-3-carboxylic acid
CID 59419539
N-[5-(2-hydroxypropan-2-yl)-3-pyridinyl]-6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxo-3-pyridinyl)pyridine-3-carboxamide
CID 118889548
4-(6-azaspiro[2.5]octan-6-yl)-3-cyano-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid
CID 138518072
3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid
CID 138518214
4-(4-methoxy-4-methylpiperidin-1-yl)-3-methyl-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid
CID 148913523
1-[1-[3-cyano-6-[(1R)-1-hydroxyethyl]-2-oxo-1H-1,7-naphthyridin-4-yl]-4-methylpiperidin-4-yl]oxy-6-[(1S)-1-hydroxyethyl]-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1,7-naphthyridine-3-carbonitrile
CID 155019518
Methyl 5-[4-[(7-Ethyl-6-oxo-5,6-dihydro-1,5-naphthyridin-3-yl)methyl]piperazin-1-yl]picolinate
CID 155586998
6-[[Bis(pyridin-2-ylmethyl)amino]methyl]pyridine-3-carboxylic acid;tert-butyl 4-[6-[[bis(pyridin-2-ylmethyl)amino]methyl]pyridine-3-carbonyl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate
CID 157373503

Frequently Asked Questions

What is the IUPAC name of 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride?
The IUPAC name of 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride (CID 158109157) is 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride.
What is the SMILES notation for 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride?
The canonical SMILES for 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride is CNC.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)N(C)C)cc23)CC1.COC1(C)CCN(c2c(C#N)c(=O)[nH]c3cnc(C(=O)O)cc23)CC1.Cl.
What is the InChIKey of 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride?
The InChIKey is BRZFEEDKSNDGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O3.C17H18N4O4.C2H7N.ClH/c1-19(27-4)5-7-24(8-6-19)16-12-9-14(18(26)23(2)3)21-11-15(12)22-17(25)13(16)10-20;1-17(25-2)3-5-21(6-4-17)14-10-7-12(16(23)24)19-9-13(10)20-15(22)11(14)8-18;1-3-2;/h9,11H,5-8H2,1-4H3,(H,22,25);7,9H,3-6H2,1-2H3,(H,20,22)(H,23,24);3H,1-2H3;1H.
What are the key properties of 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride?
3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride has a molecular weight of 793.33 g/mol, XLogP of 3.26, 6 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-N,N-dimethyl-2-oxo-1H-1,7-naphthyridine-6-carboxamide;3-cyano-4-(4-methoxy-4-methylpiperidin-1-yl)-2-oxo-1H-1,7-naphthyridine-6-carboxylic acid;N-methylmethanamine;hydrochloride is sourced from PubChem (CID 158109157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).