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

C17H26N4O — CID 167828040

IUPACN-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CC1
InChIInChI=1S/C17H26N4O/c1-13-5-9-21(10-6-13)15-4-3-14(11-19-15)16(22)20-12-17(18-2)7-8-17/h3-4,11,13,18H,5-10,12H2,1-2H3,(H,20,22)
InChIKeyBQUFDCVAFBWPMF-UHFFFAOYSA-N
MW302.42 g/mol
LogP1.80
Rot. Bonds5

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

N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 167828040) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID167828040
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC NameN-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCNC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CC1
InChIInChI=1S/C17H26N4O/c1-13-5-9-21(10-6-13)15-4-3-14(11-19-15)16(22)20-12-17(18-2)7-8-17/h3-4,11,13,18H,5-10,12H2,1-2H3,(H,20,22)
InChIKeyBQUFDCVAFBWPMF-UHFFFAOYSA-N
XLogP1.80
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 111332971
N-[[1-[2-(methylamino)-2-oxoethyl]cyclohexyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 146136407
N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370
N-(2-amino-2-ethylbutyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119641202
6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
CID 146150272
N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 119528228
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569
5-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]pyridine-2,5-dicarboxamide
CID 86859111
N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 97023794
(2S)-3-methyl-2-[[6-(4-methylpiperidin-1-yl)pyridine-3-carbonyl]amino]butanoic acid
CID 119360590
N-[3-(aminomethyl)pentan-3-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119569884
4-(dimethylamino)-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]benzamide
CID 55846067

Frequently Asked Questions

What is the IUPAC name of N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 167828040) is N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CNC1(CNC(=O)c2ccc(N3CCC(C)CC3)nc2)CC1.
What is the InChIKey of N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is BQUFDCVAFBWPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-13-5-9-21(10-6-13)15-4-3-14(11-19-15)16(22)20-12-17(18-2)7-8-17/h3-4,11,13,18H,5-10,12H2,1-2H3,(H,20,22).
What are the key properties of N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 167828040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).