2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide

C16H23N5O2 — CID 112530807

IUPAC2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
SMILESCN(C)C(=O)N1CCc2c(cncc2C(=O)NC2CCNC2)C1
InChIInChI=1S/C16H23N5O2/c1-20(2)16(23)21-6-4-13-11(10-21)7-18-9-14(13)15(22)19-12-3-5-17-8-12/h7,9,12,17H,3-6,8,10H2,1-2H3,(H,19,22)
InChIKeyBKQVMHYVKAREOQ-UHFFFAOYSA-N
MW317.39 g/mol
LogP0.21
Rot. Bonds2

About 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide

2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide (PubChem CID 112530807) has the molecular formula C16H23N5O2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
PubChem CID112530807
Molecular FormulaC16H23N5O2
Molecular Weight317.39 g/mol
Exact Mass317.19
IUPAC Name2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
SMILESCN(C)C(=O)N1CCc2c(cncc2C(=O)NC2CCNC2)C1
InChIInChI=1S/C16H23N5O2/c1-20(2)16(23)21-6-4-13-11(10-21)7-18-9-14(13)15(22)19-12-3-5-17-8-12/h7,9,12,17H,3-6,8,10H2,1-2H3,(H,19,22)
InChIKeyBKQVMHYVKAREOQ-UHFFFAOYSA-N
XLogP0.21
TPSA77.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-methylsulfonyl-N-pyrrolidin-3-yl-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
CID 112530801
5-N-[(4-fluorophenyl)methyl]-2-N,2-N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112528408
5-N-(5-chloro-2-methylphenyl)-2-N,2-N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112523206
2-N,2-N-dimethyl-5-N-(2-methyl-1H-indol-4-yl)-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112526494
5-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-N,2-N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112529860
5-N-(1,2-dimethylbenzimidazol-5-yl)-2-N,2-N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide
CID 112527574
N-cyclohexyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520196
7-(2-methylpropanoyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carboxylic acid
CID 110476748
5-[4-(2-aminoethyl)-3,5-dimethylpyrazole-1-carbonyl]-N,N-dimethyl-3,4-dihydro-1H-2,7-naphthyridine-2-carboxamide
CID 112529977
7-acetyl-N-(4-methylphenyl)-6,8-dihydro-5H-2,7-naphthyridine-4-carboxamide
CID 112521061
methyl 7-[4-(dimethylamino)benzoyl]-6,8-dihydro-5H-2,7-naphthyridine-4-carboxylate
CID 112535220
N,N,1-trimethyl-2,6,8,9-tetrahydropyrazolo[4,3-f][2,7]naphthyridine-7-carboxamide
CID 91154935

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide (CID 112530807) is 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide is CN(C)C(=O)N1CCc2c(cncc2C(=O)NC2CCNC2)C1.
What is the InChIKey of 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide?
The InChIKey is BKQVMHYVKAREOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O2/c1-20(2)16(23)21-6-4-13-11(10-21)7-18-9-14(13)15(22)19-12-3-5-17-8-12/h7,9,12,17H,3-6,8,10H2,1-2H3,(H,19,22).
What are the key properties of 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide?
2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide has a molecular weight of 317.39 g/mol, XLogP of 0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethyl-5-N-pyrrolidin-3-yl-3,4-dihydro-1H-2,7-naphthyridine-2,5-dicarboxamide is sourced from PubChem (CID 112530807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).