N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C20H26N4O — CID 119528228

IUPACN-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC(N)c3ccccc3)cn2)CC1
InChIInChI=1S/C20H26N4O/c1-15-9-11-24(12-10-15)19-8-7-17(13-22-19)20(25)23-14-18(21)16-5-3-2-4-6-16/h2-8,13,15,18H,9-12,14,21H2,1H3,(H,23,25)
InChIKeyOCGKRMPFYBYVGV-UHFFFAOYSA-N
MW338.46 g/mol
LogP2.75
Rot. Bonds5

About N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 119528228) has the molecular formula C20H26N4O and a molecular weight of 338.46 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID119528228
Molecular FormulaC20H26N4O
Molecular Weight338.46 g/mol
Exact Mass338.21
IUPAC NameN-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)NCC(N)c3ccccc3)cn2)CC1
InChIInChI=1S/C20H26N4O/c1-15-9-11-24(12-10-15)19-8-7-17(13-22-19)20(25)23-14-18(21)16-5-3-2-4-6-16/h2-8,13,15,18H,9-12,14,21H2,1H3,(H,23,25)
InChIKeyOCGKRMPFYBYVGV-UHFFFAOYSA-N
XLogP2.75
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(methylamino)propyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 120827370
(2S)-3-methyl-2-[[6-(4-methylpiperidin-1-yl)pyridine-3-carbonyl]amino]butanoic acid
CID 119360590
N-(2-amino-2-ethylbutyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119641202
N-[[1-(methylamino)cyclopropyl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 167828040
N-[(1-hydroxycyclopentyl)methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 111332971
5-N-[[6-(4-methylpiperidin-1-yl)-3-pyridinyl]methyl]pyridine-2,5-dicarboxamide
CID 86859111
N-[[1-(difluoromethyl)indol-3-yl]methyl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 146099784
6-(4-methylpiperidin-1-yl)-N-[2-[(1-methylpiperidin-4-yl)amino]-2-oxoethyl]pyridine-3-carboxamide
CID 146150272
N-(4-acetamidophenyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109152569
N-[3-(aminomethyl)pentan-3-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide;dihydrochloride
CID 119569884
6-(4-methylpiperidin-1-yl)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109152560
N-(3-aminobutyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 119495810

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 119528228) is N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)NCC(N)c3ccccc3)cn2)CC1.
What is the InChIKey of N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is OCGKRMPFYBYVGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-15-9-11-24(12-10-15)19-8-7-17(13-22-19)20(25)23-14-18(21)16-5-3-2-4-6-16/h2-8,13,15,18H,9-12,14,21H2,1H3,(H,23,25).
What are the key properties of N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 338.46 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 119528228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).