N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C22H34N4O2 — CID 146136407

IUPACN-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC(=O)CC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CCCCC1
InChIInChI=1S/C22H34N4O2/c1-17-8-12-26(13-9-17)19-7-6-18(15-24-19)21(28)25-16-22(14-20(27)23-2)10-4-3-5-11-22/h6-7,15,17H,3-5,8-14,16H2,1-2H3,(H,23,27)(H,25,28)
InChIKeyKJDSFJPREZZHBS-UHFFFAOYSA-N
MW386.54 g/mol
LogP3.13
Rot. Bonds6

About N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 146136407) has the molecular formula C22H34N4O2 and a molecular weight of 386.54 g/mol. Its IUPAC name is N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID146136407
Molecular FormulaC22H34N4O2
Molecular Weight386.54 g/mol
Exact Mass386.27
IUPAC NameN-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC(=O)CC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CCCCC1
InChIInChI=1S/C22H34N4O2/c1-17-8-12-26(13-9-17)19-7-6-18(15-24-19)21(28)25-16-22(14-20(27)23-2)10-4-3-5-11-22/h6-7,15,17H,3-5,8-14,16H2,1-2H3,(H,23,27)(H,25,28)
InChIKeyKJDSFJPREZZHBS-UHFFFAOYSA-N
XLogP3.13
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide 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

N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 111332971
N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 167828040
N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569
6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
CID 146150272
N-(2-amino-2-ethylbutyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119641202
N-[1-(5-ethyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 126780940
N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 97023794
N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 119528228
N-[3-(aminomethyl)pentan-3-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119569884
5-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]pyridine-2,5-dicarboxamide
CID 86859111
N-(2,2-dimethyloxan-4-yl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 126768074

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 146136407) is N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CNC(=O)CC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CCCCC1.
What is the InChIKey of N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is KJDSFJPREZZHBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N4O2/c1-17-8-12-26(13-9-17)19-7-6-18(15-24-19)21(28)25-16-22(14-20(27)23-2)10-4-3-5-11-22/h6-7,15,17H,3-5,8-14,16H2,1-2H3,(H,23,27)(H,25,28).
What are the key properties of N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 386.54 g/mol, XLogP of 3.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 146136407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).