N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide

C14H13N3O3 — CID 650463

IUPACN-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)nc1)c1ccco1
InChIInChI=1S/C14H13N3O3/c18-13(9-3-4-9)17-12-6-5-10(8-15-12)16-14(19)11-2-1-7-20-11/h1-2,5-9H,3-4H2,(H,16,19)(H,15,17,18)
InChIKeyHGAGCGAWCAAFKO-UHFFFAOYSA-N
MW271.28 g/mol
LogP2.28
Rot. Bonds4

About N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide

N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide (PubChem CID 650463) has the molecular formula C14H13N3O3 and a molecular weight of 271.28 g/mol. Its IUPAC name is N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide
PubChem CID650463
Molecular FormulaC14H13N3O3
Molecular Weight271.28 g/mol
Exact Mass271.10
IUPAC NameN-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NC(=O)C2CC2)nc1)c1ccco1
InChIInChI=1S/C14H13N3O3/c18-13(9-3-4-9)17-12-6-5-10(8-15-12)16-14(19)11-2-1-7-20-11/h1-2,5-9H,3-4H2,(H,16,19)(H,15,17,18)
InChIKeyHGAGCGAWCAAFKO-UHFFFAOYSA-N
XLogP2.28
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.28
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide (CID 650463) is N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide is O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1ccco1.
What is the InChIKey of N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide?
The InChIKey is HGAGCGAWCAAFKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O3/c18-13(9-3-4-9)17-12-6-5-10(8-15-12)16-14(19)11-2-1-7-20-11/h1-2,5-9H,3-4H2,(H,16,19)(H,15,17,18).
What are the key properties of N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide?
N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide has a molecular weight of 271.28 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(cyclopropanecarbonylamino)-3-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 650463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).