N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide

C19H25N3O — CID 109160732

IUPACN,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(NCCCc2ccccc2)nc1
InChIInChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-12-13-18(21-15-17)20-14-8-11-16-9-6-5-7-10-16/h5-7,9-10,12-13,15H,3-4,8,11,14H2,1-2H3,(H,20,21)
InChIKeySWDZNTVDIYXNMD-UHFFFAOYSA-N
MW311.43 g/mol
LogP3.61
Rot. Bonds8

About N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide

N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide (PubChem CID 109160732) has the molecular formula C19H25N3O and a molecular weight of 311.43 g/mol. Its IUPAC name is N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
PubChem CID109160732
Molecular FormulaC19H25N3O
Molecular Weight311.43 g/mol
Exact Mass311.20
IUPAC NameN,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(NCCCc2ccccc2)nc1
InChIInChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-12-13-18(21-15-17)20-14-8-11-16-9-6-5-7-10-16/h5-7,9-10,12-13,15H,3-4,8,11,14H2,1-2H3,(H,20,21)
InChIKeySWDZNTVDIYXNMD-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-ethyl-N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160792
N-benzyl-6-(butylamino)-N-methylpyridine-3-carboxamide
CID 109151561
6-(pentylamino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158304
6-[2-(dimethylamino)ethylamino]-N,N-diethylpyridine-3-carboxamide
CID 109153766
N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-benzyl-N-ethyl-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109157599
N,N-diethyl-5-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109238757
N,N-diethyl-6-[2-(1H-indol-3-yl)ethylamino]pyridine-3-carboxamide
CID 109159691
6-(2-phenylethylamino)-N-propylpyridine-3-carboxamide
CID 109151243
N-benzyl-6-(2-phenylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109158221
N-benzyl-6-(pentylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109161120
N,N-diethyl-4-(3-phenylpropyl)benzamide
CID 102226026

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The IUPAC name of N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide (CID 109160732) is N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The canonical SMILES for N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide is CCN(CC)C(=O)c1ccc(NCCCc2ccccc2)nc1.
What is the InChIKey of N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The InChIKey is SWDZNTVDIYXNMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O/c1-3-22(4-2)19(23)17-12-13-18(21-15-17)20-14-8-11-16-9-6-5-7-10-16/h5-7,9-10,12-13,15H,3-4,8,11,14H2,1-2H3,(H,20,21).
What are the key properties of N,N-diethyl-6-(3-phenylpropylamino)pyridine-3-carboxamide?
N,N-diethyl-6-(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-6-(3-phenylpropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109160732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).