4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide

C22H31N5O — CID 89358315

IUPAC4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide
SMILESCCCN(CCC)c1cc(N/N=C/c2cccc(C)c2)nc(C(=O)N(C)C)c1
InChIInChI=1S/C22H31N5O/c1-6-11-27(12-7-2)19-14-20(22(28)26(4)5)24-21(15-19)25-23-16-18-10-8-9-17(3)13-18/h8-10,13-16H,6-7,11-12H2,1-5H3,(H,24,25)/b23-16+
InChIKeyZUVVWFXPTOMKHM-XQNSMLJCSA-N
MW381.52 g/mol
LogP4.16
Rot. Bonds9

About 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide

4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide (PubChem CID 89358315) has the molecular formula C22H31N5O and a molecular weight of 381.52 g/mol. Its IUPAC name is 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide
PubChem CID89358315
Molecular FormulaC22H31N5O
Molecular Weight381.52 g/mol
Exact Mass381.25
IUPAC Name4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide
SMILESCCCN(CCC)c1cc(N/N=C/c2cccc(C)c2)nc(C(=O)N(C)C)c1
InChIInChI=1S/C22H31N5O/c1-6-11-27(12-7-2)19-14-20(22(28)26(4)5)24-21(15-19)25-23-16-18-10-8-9-17(3)13-18/h8-10,13-16H,6-7,11-12H2,1-5H3,(H,24,25)/b23-16+
InChIKeyZUVVWFXPTOMKHM-XQNSMLJCSA-N
XLogP4.16
TPSA60.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-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

2-[[4-(dipropylamino)-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-2-pyridinyl]oxy]ethyl N-phenylcarbamate
CID 89332304
6-N-ethyl-2-N-[(E)-(3-methylphenyl)methylideneamino]-6-N-(2-morpholin-4-ylethyl)-4-N,4-N-dipropylpyridine-2,4,6-triamine
CID 89358423
4-[2-[[4-(dipropylamino)-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-2-pyridinyl]oxy]ethoxy]butan-1-ol
CID 89332299
6-[2-[(5-fluoro-2-pyridinyl)oxy]ethoxy]-2-N-[(E)-(3-methylphenyl)methylideneamino]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 89331892
6-[2-(4-ethyl-3-methylpiperazin-1-yl)ethoxy]-2-N-[(E)-(3-methylphenyl)methylideneamino]-4-N,4-N-dipropylpyridine-2,4-diamine
CID 143450305
2-N,4-N-bis[(3-methylphenyl)methylideneamino]pyrimidine-2,4,6-triamine
CID 66684301
2-N,4-N-bis[(E)-(3-methylphenyl)methylideneamino]pyrimidine-2,4,6-triamine
CID 11537766
5-[2-[(3-methylphenyl)methylidene]hydrazinyl]-2H-1,2,4-triazin-3-one
CID 2789180
CID 138691667
CID 138691667
ethyl N-[(3-methylphenyl)methylideneamino]carbamate
CID 2692645
3-(3-methyl-N-propylanilino)propanoic acid
CID 82317776
ethyl 3-[4-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]-6-piperidin-1-ylpyrimidin-2-yl]propanoate
CID 143341240

Frequently Asked Questions

What is the IUPAC name of 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide?
The IUPAC name of 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide (CID 89358315) is 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide?
The canonical SMILES for 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide is CCCN(CCC)c1cc(N/N=C/c2cccc(C)c2)nc(C(=O)N(C)C)c1.
What is the InChIKey of 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide?
The InChIKey is ZUVVWFXPTOMKHM-XQNSMLJCSA-N. The full InChI is InChI=1S/C22H31N5O/c1-6-11-27(12-7-2)19-14-20(22(28)26(4)5)24-21(15-19)25-23-16-18-10-8-9-17(3)13-18/h8-10,13-16H,6-7,11-12H2,1-5H3,(H,24,25)/b23-16+.
What are the key properties of 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide?
4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide has a molecular weight of 381.52 g/mol, XLogP of 4.16, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dipropylamino)-N,N-dimethyl-6-[(2E)-2-[(3-methylphenyl)methylidene]hydrazinyl]pyridine-2-carboxamide is sourced from PubChem (CID 89358315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).