4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide

C19H24ClN3O — CID 109211884

IUPAC4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc(NCc2ccc(Cl)cc2)ccn1
InChIInChI=1S/C19H24ClN3O/c1-3-11-23(12-4-2)19(24)18-13-17(9-10-21-18)22-14-15-5-7-16(20)8-6-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,22)
InChIKeyGOCTVRRFHOTWGL-UHFFFAOYSA-N
MW345.87 g/mol
LogP4.61
Rot. Bonds8

About 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide

4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide (PubChem CID 109211884) has the molecular formula C19H24ClN3O and a molecular weight of 345.87 g/mol. Its IUPAC name is 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide
PubChem CID109211884
Molecular FormulaC19H24ClN3O
Molecular Weight345.87 g/mol
Exact Mass345.16
IUPAC Name4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide
SMILESCCCN(CCC)C(=O)c1cc(NCc2ccc(Cl)cc2)ccn1
InChIInChI=1S/C19H24ClN3O/c1-3-11-23(12-4-2)19(24)18-13-17(9-10-21-18)22-14-15-5-7-16(20)8-6-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,22)
InChIKeyGOCTVRRFHOTWGL-UHFFFAOYSA-N
XLogP4.61
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.87
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(4-chlorophenyl)ethylamino]-N,N-dipropylpyridine-2-carboxamide
CID 109215470
N,N-dipropyl-4-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109213420
4-[(4-chlorophenyl)methylamino]-N-methylpyridine-2-carboxamide
CID 43395704
2-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-4-carboxamide
CID 109170952
2-N-[(4-chlorophenyl)methyl]-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109086759
N-[(4-chlorophenyl)methyl]-4-(ethylamino)pyridine-2-carboxamide
CID 62186393
4-N-[2-(4-chlorophenyl)ethyl]-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109088514
4-[(4-chlorophenyl)methylamino]-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109211857
4-[(4-chlorophenyl)methylamino]-N-phenylpyridine-2-carboxamide
CID 109211886
4-[[4-(hydroxymethyl)phenyl]methylamino]-N,N-dimethylpyridine-2-carboxamide
CID 107232295
1-[4-[4-[(4-chlorophenyl)methylamino]pyridine-2-carbonyl]piperazin-1-yl]ethanone
CID 109209018
N-(3-acetamidophenyl)-4-[(4-chlorophenyl)methylamino]pyridine-2-carboxamide
CID 109211921

Frequently Asked Questions

What is the IUPAC name of 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide?
The IUPAC name of 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide (CID 109211884) is 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide.
What is the SMILES notation for 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide?
The canonical SMILES for 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide is CCCN(CCC)C(=O)c1cc(NCc2ccc(Cl)cc2)ccn1.
What is the InChIKey of 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide?
The InChIKey is GOCTVRRFHOTWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24ClN3O/c1-3-11-23(12-4-2)19(24)18-13-17(9-10-21-18)22-14-15-5-7-16(20)8-6-15/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,21,22).
What are the key properties of 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide?
4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide has a molecular weight of 345.87 g/mol, XLogP of 4.61, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-chlorophenyl)methylamino]-N,N-dipropylpyridine-2-carboxamide is sourced from PubChem (CID 109211884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).