N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride

C19H24Cl2N4O2 — CID 119378723

IUPACN-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
SMILESCc1cccc(C(=O)N2CCCC(N)C2)c1NC(=O)c1ccncc1.Cl.Cl
InChIInChI=1S/C19H22N4O2.2ClH/c1-13-4-2-6-16(19(25)23-11-3-5-15(20)12-23)17(13)22-18(24)14-7-9-21-10-8-14;;/h2,4,6-10,15H,3,5,11-12,20H2,1H3,(H,22,24);2*1H
InChIKeyNUGVLOYJQOGBMB-UHFFFAOYSA-N
MW411.33 g/mol
LogP3.05
Rot. Bonds3

About N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride

N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride (PubChem CID 119378723) has the molecular formula C19H24Cl2N4O2 and a molecular weight of 411.33 g/mol. Its IUPAC name is N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
PubChem CID119378723
Molecular FormulaC19H24Cl2N4O2
Molecular Weight411.33 g/mol
Exact Mass410.13
IUPAC NameN-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
SMILESCc1cccc(C(=O)N2CCCC(N)C2)c1NC(=O)c1ccncc1.Cl.Cl
InChIInChI=1S/C19H22N4O2.2ClH/c1-13-4-2-6-16(19(25)23-11-3-5-15(20)12-23)17(13)22-18(24)14-7-9-21-10-8-14;;/h2,4,6-10,15H,3,5,11-12,20H2,1H3,(H,22,24);2*1H
InChIKeyNUGVLOYJQOGBMB-UHFFFAOYSA-N
XLogP3.05
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.33
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride 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-[2-[3-(aminomethyl)pyrrolidine-1-carbonyl]-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
CID 119484588
N-[2-[3-(1-aminoethyl)piperidine-1-carbonyl]-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
CID 119594102
N-[2-[4-(cyclopropylmethylamino)piperidine-1-carbonyl]-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride
CID 119622893
N-[3-(3-aminopiperidine-1-carbonyl)phenyl]pyridine-3-carboxamide;dihydrochloride
CID 119381577
4-cyano-N-[2-methyl-6-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 86980033
(3-aminopiperidin-1-yl)-(3,4-dimethylphenyl)methanone;hydrochloride
CID 119381443
(3-aminopiperidin-1-yl)-(2-methyl-3-nitrophenyl)methanone;hydrochloride
CID 119377680
2-(3-aminopiperidine-1-carbonyl)benzoic acid
CID 61403703
[3-(methylaminomethyl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 61204344
(3-aminopiperidin-1-yl)-(2-methyl-4-pyridinyl)methanone
CID 106752260
N-[2-methyl-6-(2-piperidin-3-ylethylcarbamoyl)phenyl]pyridine-4-carboxamide;dihydrochloride
CID 119556509
(3-aminopiperidin-1-yl)-(2-methyl-5-methylsulfanylphenyl)methanone;hydrochloride
CID 119379154

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride?
The IUPAC name of N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride (CID 119378723) is N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride is Cc1cccc(C(=O)N2CCCC(N)C2)c1NC(=O)c1ccncc1.Cl.Cl.
What is the InChIKey of N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride?
The InChIKey is NUGVLOYJQOGBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2.2ClH/c1-13-4-2-6-16(19(25)23-11-3-5-15(20)12-23)17(13)22-18(24)14-7-9-21-10-8-14;;/h2,4,6-10,15H,3,5,11-12,20H2,1H3,(H,22,24);2*1H.
What are the key properties of N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride?
N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride has a molecular weight of 411.33 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-aminopiperidine-1-carbonyl)-6-methylphenyl]pyridine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119378723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).