N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide

C21H24N4O — CID 109240993

IUPACN,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1cncc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C21H24N4O/c1-3-11-25(12-4-2)21(26)17-13-18(15-22-14-17)24-19-9-5-7-16-8-6-10-23-20(16)19/h5-10,13-15,24H,3-4,11-12H2,1-2H3
InChIKeyLIQLCBVQWYSGCG-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.64
Rot. Bonds7

About N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide

N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide (PubChem CID 109240993) has the molecular formula C21H24N4O and a molecular weight of 348.45 g/mol. Its IUPAC name is N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
PubChem CID109240993
Molecular FormulaC21H24N4O
Molecular Weight348.45 g/mol
Exact Mass348.20
IUPAC NameN,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1cncc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C21H24N4O/c1-3-11-25(12-4-2)21(26)17-13-18(15-22-14-17)24-19-9-5-7-16-8-6-10-23-20(16)19/h5-10,13-15,24H,3-4,11-12H2,1-2H3
InChIKeyLIQLCBVQWYSGCG-UHFFFAOYSA-N
XLogP4.64
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-ethyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109234803
5-(quinolin-8-ylamino)pyridine-3-carboxylic acid
CID 82535032
5-(2,3-dichloroanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109241006
N-(2-ethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109243373
N-tert-butyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109239349
N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109231433
N-(3,4-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109242937
methyl 3-[[5-(dipropylcarbamoyl)-3-pyridinyl]amino]benzoate
CID 109240973
5-(4-methylanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109240921
5-(4-chloroanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109240944
5-(2-tert-butylanilino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109244039
5-(3,5-dichloroanilino)-N,N-dipropylpyridine-3-carboxamide
CID 109241004

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The IUPAC name of N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide (CID 109240993) is N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide is CCCN(CCC)C(=O)c1cncc(Nc2cccc3cccnc23)c1.
What is the InChIKey of N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
The InChIKey is LIQLCBVQWYSGCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O/c1-3-11-25(12-4-2)21(26)17-13-18(15-22-14-17)24-19-9-5-7-16-8-6-10-23-20(16)19/h5-10,13-15,24H,3-4,11-12H2,1-2H3.
What are the key properties of N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide?
N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 4.64, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-5-(quinolin-8-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109240993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).