N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide

C21H16N4O — CID 112989314

IUPACN-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1cccnc1
InChIInChI=1S/C21H16N4O/c26-21(16-6-2-12-22-14-16)25-18-10-8-17(9-11-18)24-19-7-1-4-15-5-3-13-23-20(15)19/h1-14,24H,(H,25,26)
InChIKeyUGUYTPIIQHSRJD-UHFFFAOYSA-N
MW340.39 g/mol
LogP4.63
Rot. Bonds4

About N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide

N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide (PubChem CID 112989314) has the molecular formula C21H16N4O and a molecular weight of 340.39 g/mol. Its IUPAC name is N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide
PubChem CID112989314
Molecular FormulaC21H16N4O
Molecular Weight340.39 g/mol
Exact Mass340.13
IUPAC NameN-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1cccnc1
InChIInChI=1S/C21H16N4O/c26-21(16-6-2-12-22-14-16)25-18-10-8-17(9-11-18)24-19-7-1-4-15-5-3-13-23-20(15)19/h1-14,24H,(H,25,26)
InChIKeyUGUYTPIIQHSRJD-UHFFFAOYSA-N
XLogP4.63
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethylphenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109242937
5-(4-acetamidoanilino)-N-quinolin-8-ylpyridine-3-carboxamide
CID 109245897
N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide
CID 112989291
methyl N-[4-(quinolin-8-ylamino)phenyl]carbamate
CID 112989327
N-(3-cyanophenyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109246222
5-(quinolin-8-ylamino)pyridine-3-carboxylic acid
CID 82535032
2-(4-acetylanilino)-N-quinolin-8-ylpyrimidine-5-carboxamide
CID 109270127
3-chloro-N-[5-(quinolin-8-ylamino)-2-pyridinyl]benzamide
CID 113036320
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-[4-(dimethylamino)phenyl]-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200554
3-N-(3,4-dimethylphenyl)-5-N-quinolin-8-ylpyridine-3,5-dicarboxamide
CID 109108326
4-chloro-N-[6-(quinolin-8-ylamino)-3-pyridinyl]benzamide
CID 113021752

Frequently Asked Questions

What is the IUPAC name of N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide (CID 112989314) is N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide is O=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1cccnc1.
What is the InChIKey of N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide?
The InChIKey is UGUYTPIIQHSRJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O/c26-21(16-6-2-12-22-14-16)25-18-10-8-17(9-11-18)24-19-7-1-4-15-5-3-13-23-20(15)19/h1-14,24H,(H,25,26).
What are the key properties of N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide?
N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide has a molecular weight of 340.39 g/mol, XLogP of 4.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 112989314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).