N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide

C19H25N3O — CID 109238757

IUPACN,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(NCCCc2ccccc2)c1
InChIInChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-13-18(15-20-14-17)21-12-8-11-16-9-6-5-7-10-16/h5-7,9-10,13-15,21H,3-4,8,11-12H2,1-2H3
InChIKeyFFFMHFDUXABYQO-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.61
Rot. Bonds8

About N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide

N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide (PubChem CID 109238757) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
PubChem CID109238757
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC NameN,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1cncc(NCCCc2ccccc2)c1
InChIInChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-13-18(15-20-14-17)21-12-8-11-16-9-6-5-7-10-16/h5-7,9-10,13-15,21H,3-4,8,11-12H2,1-2H3
InChIKeyFFFMHFDUXABYQO-UHFFFAOYSA-N
XLogP3.61
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-tert-butyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109239083
N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160732
5-N-benzyl-5-N-ethyl-3-N-(2-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105843
5-(butylamino)-N,N-dipropylpyridine-3-carboxamide
CID 109224616
methyl 4-[[5-(3-phenylpropylamino)pyridine-3-carbonyl]amino]benzoate
CID 109239144
N-[(2-chlorophenyl)methyl]-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109233806
N,N-diethyl-4-(2-phenylethylamino)benzamide
CID 174426094
3-N-methyl-5-N-(3-phenylpropyl)pyridine-3,5-diamine
CID 113423751
5-(tert-butylamino)-N,N-diethylpyridine-3-carboxamide
CID 109238760
N-(furan-2-ylmethyl)-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109231335
N-(2,4-dimethylphenyl)-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109239101
5-(benzylamino)-N-butyl-N-methylpyridine-3-carboxamide
CID 109231838

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide (CID 109238757) is N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide is CCN(CC)C(=O)c1cncc(NCCCc2ccccc2)c1.
What is the InChIKey of N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide?
The InChIKey is FFFMHFDUXABYQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-13-18(15-20-14-17)21-12-8-11-16-9-6-5-7-10-16/h5-7,9-10,13-15,21H,3-4,8,11-12H2,1-2H3.
What are the key properties of N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide?
N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide has a molecular weight of 311.43 g/mol, XLogP of 3.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109238757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).