N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine

C24H34N4O2 — CID 156646639

IUPACN-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine
SMILESCNC(C)C.Cc1cc(NC(=O)CC2CCCC2)ccc1-c1cnc(N)c(C=O)c1
InChIInChI=1S/C20H23N3O2.C4H11N/c1-13-8-17(23-19(25)9-14-4-2-3-5-14)6-7-18(13)15-10-16(12-24)20(21)22-11-15;1-4(2)5-3/h6-8,10-12,14H,2-5,9H2,1H3,(H2,21,22)(H,23,25);4-5H,1-3H3
InChIKeyPAXWSZSYXASSBL-UHFFFAOYSA-N
MW410.56 g/mol
LogP4.58
Rot. Bonds6

About N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine

N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine (PubChem CID 156646639) has the molecular formula C24H34N4O2 and a molecular weight of 410.56 g/mol. Its IUPAC name is N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine
PubChem CID156646639
Molecular FormulaC24H34N4O2
Molecular Weight410.56 g/mol
Exact Mass410.27
IUPAC NameN-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine
SMILESCNC(C)C.Cc1cc(NC(=O)CC2CCCC2)ccc1-c1cnc(N)c(C=O)c1
InChIInChI=1S/C20H23N3O2.C4H11N/c1-13-8-17(23-19(25)9-14-4-2-3-5-14)6-7-18(13)15-10-16(12-24)20(21)22-11-15;1-4(2)5-3/h6-8,10-12,14H,2-5,9H2,1H3,(H2,21,22)(H,23,25);4-5H,1-3H3
InChIKeyPAXWSZSYXASSBL-UHFFFAOYSA-N
XLogP4.58
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.56
LogP ≤ 54.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine 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-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-(3,5-difluorophenyl)acetamide;N-methylpropan-2-amine
CID 156646549
N-(3-amino-4-methylphenyl)-2-cyclohexylacetamide
CID 43209699
N-(4-bromo-3-methylphenyl)-2-cyclopentylacetamide
CID 2679466
N-(3-amino-4-ethylphenyl)-2-cyclohexylacetamide
CID 43550224
2-cyclobutyl-N-(4-methyl-3-pyridin-2-ylphenyl)acetamide
CID 169175816
N-(6-chloro-5-methyl-3-pyridinyl)-2-cyclohexylacetamide
CID 103730501
5-[(2-cyclobutylacetyl)amino]-2-methylbenzoic acid
CID 113352851
N-(6-amino-3-pyridinyl)-2-cyclopentylacetamide;hydrochloride
CID 119260450
2-cyclobutyl-N-[3-[1-(methylamino)ethyl]phenyl]acetamide
CID 103162221
2-cyclopentyl-N-[3-fluoro-4-(methylamino)phenyl]acetamide
CID 167956029
2-cyclohexyl-N-[6-(methylamino)-3-pyridinyl]acetamide
CID 115274700
2-cyclopentyl-N-(4-propan-2-ylphenyl)acetamide
CID 11839703

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine?
The IUPAC name of N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine (CID 156646639) is N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine.
What is the SMILES notation for N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine?
The canonical SMILES for N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine is CNC(C)C.Cc1cc(NC(=O)CC2CCCC2)ccc1-c1cnc(N)c(C=O)c1.
What is the InChIKey of N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine?
The InChIKey is PAXWSZSYXASSBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2.C4H11N/c1-13-8-17(23-19(25)9-14-4-2-3-5-14)6-7-18(13)15-10-16(12-24)20(21)22-11-15;1-4(2)5-3/h6-8,10-12,14H,2-5,9H2,1H3,(H2,21,22)(H,23,25);4-5H,1-3H3.
What are the key properties of N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine?
N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine has a molecular weight of 410.56 g/mol, XLogP of 4.58, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-amino-5-formyl-3-pyridinyl)-3-methylphenyl]-2-cyclopentylacetamide;N-methylpropan-2-amine is sourced from PubChem (CID 156646639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).