6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide

C14H13N3O — CID 175906033

IUPAC6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc(C2CC2)nc1
InChIInChI=1S/C14H13N3O/c18-14(17-12-2-1-7-15-9-12)11-5-6-13(16-8-11)10-3-4-10/h1-2,5-10H,3-4H2,(H,17,18)
InChIKeyDMFAZZUPWIDEMI-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.61
Rot. Bonds3

About 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide

6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide (PubChem CID 175906033) has the molecular formula C14H13N3O and a molecular weight of 239.28 g/mol. Its IUPAC name is 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide
PubChem CID175906033
Molecular FormulaC14H13N3O
Molecular Weight239.28 g/mol
Exact Mass239.11
IUPAC Name6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide
SMILESO=C(Nc1cccnc1)c1ccc(C2CC2)nc1
InChIInChI=1S/C14H13N3O/c18-14(17-12-2-1-7-15-9-12)11-5-6-13(16-8-11)10-3-4-10/h1-2,5-10H,3-4H2,(H,17,18)
InChIKeyDMFAZZUPWIDEMI-UHFFFAOYSA-N
XLogP2.61
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-pyridin-3-ylbenzamide
CID 15965764
4-(cyclopropylcarbamoylamino)-N-pyridin-3-ylbenzamide
CID 39890660
N-pyridin-3-ylbenzamide;dihydrochloride
CID 174671785
1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
4-tert-butyl-N-pyridin-3-ylbenzamide
CID 676176
6-cyclopropyl-N-propan-2-ylpyridine-3-carboxamide
CID 121261417
2-cyclopropyl-N-pyridin-3-ylquinoline-4-carboxamide
CID 31745720
4-[[(3-cyclopropyl-1H-pyrazol-5-yl)methyl-methylamino]methyl]-N-pyridin-3-ylbenzamide
CID 50966519
4-[(4-chlorobenzoyl)amino]-N-pyridin-3-ylbenzamide
CID 38754764
4-(carbamoylamino)-N-pyridin-3-ylbenzamide
CID 13387851
2-cyclopropyl-N-pyridin-3-ylimidazo[1,2-b]pyridazine-6-carboxamide
CID 154853972
4-bromo-5-cyclopropyl-N-pyridin-3-yl-1H-pyrazole-3-carboxamide
CID 47080055

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide?
The IUPAC name of 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide (CID 175906033) is 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide?
The canonical SMILES for 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide is O=C(Nc1cccnc1)c1ccc(C2CC2)nc1.
What is the InChIKey of 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide?
The InChIKey is DMFAZZUPWIDEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O/c18-14(17-12-2-1-7-15-9-12)11-5-6-13(16-8-11)10-3-4-10/h1-2,5-10H,3-4H2,(H,17,18).
What are the key properties of 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide?
6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide has a molecular weight of 239.28 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-pyridin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 175906033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).