2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide

C19H16N4O2 — CID 118071036

IUPAC2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccnc(NC(=O)C2CC2)c1
InChIInChI=1S/C19H16N4O2/c24-18(12-5-6-12)23-17-10-14(7-8-20-17)19(25)22-15-9-13-3-1-2-4-16(13)21-11-15/h1-4,7-12H,5-6H2,(H,22,25)(H,20,23,24)
InChIKeyTYKWNLYHAQUQDQ-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.23
Rot. Bonds4

About 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide

2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide (PubChem CID 118071036) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide
PubChem CID118071036
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC Name2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide
SMILESO=C(Nc1cnc2ccccc2c1)c1ccnc(NC(=O)C2CC2)c1
InChIInChI=1S/C19H16N4O2/c24-18(12-5-6-12)23-17-10-14(7-8-20-17)19(25)22-15-9-13-3-1-2-4-16(13)21-11-15/h1-4,7-12H,5-6H2,(H,22,25)(H,20,23,24)
InChIKeyTYKWNLYHAQUQDQ-UHFFFAOYSA-N
XLogP3.23
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropanecarbonylamino)-N-(6-fluoro-5-methyl-3-pyridinyl)pyridine-4-carboxamide
CID 118071000
N-quinolin-3-ylpyrrolidine-3-carboxamide;dihydrochloride
CID 119840923
1-(pyrrolidine-1-carbonyl)-N-quinolin-3-ylpiperidine-4-carboxamide
CID 55718448
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385
2-(cyclopropanecarbonylamino)-N-[5-(1-methylpyrrol-3-yl)-3-pyridinyl]pyridine-4-carboxamide
CID 118065419
4-methyl-N-quinolin-3-ylbenzamide
CID 974969
4-bromo-N-quinolin-3-ylbenzamide
CID 3301629
N-(2-amino-3-pyridinyl)-2-(cyclopropanecarbonylamino)pyridine-4-carboxamide
CID 155516197
4-(2-methylbutan-2-yl)-N-quinolin-3-ylbenzamide
CID 66815675
4-[cyclopentyl(methyl)amino]-N-quinolin-3-ylbenzamide
CID 66816166
6-(methylamino)-N-quinolin-3-ylpyridine-3-carboxamide
CID 62808644
4-(azepan-1-yl)-N-quinolin-3-ylbenzamide
CID 66815489

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide?
The IUPAC name of 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide (CID 118071036) is 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide?
The canonical SMILES for 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide is O=C(Nc1cnc2ccccc2c1)c1ccnc(NC(=O)C2CC2)c1.
What is the InChIKey of 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide?
The InChIKey is TYKWNLYHAQUQDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c24-18(12-5-6-12)23-17-10-14(7-8-20-17)19(25)22-15-9-13-3-1-2-4-16(13)21-11-15/h1-4,7-12H,5-6H2,(H,22,25)(H,20,23,24).
What are the key properties of 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide?
2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropanecarbonylamino)-N-quinolin-3-ylpyridine-4-carboxamide is sourced from PubChem (CID 118071036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).