2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide

C14H17N3O2 — CID 60726854

IUPAC2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide
SMILESCC(CCc1ccco1)Nc1ncccc1C(N)=O
InChIInChI=1S/C14H17N3O2/c1-10(6-7-11-4-3-9-19-11)17-14-12(13(15)18)5-2-8-16-14/h2-5,8-10H,6-7H2,1H3,(H2,15,18)(H,16,17)
InChIKeyYZKVHZVHPMYGPP-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.21
Rot. Bonds6

About 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide

2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide (PubChem CID 60726854) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide
PubChem CID60726854
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide
SMILESCC(CCc1ccco1)Nc1ncccc1C(N)=O
InChIInChI=1S/C14H17N3O2/c1-10(6-7-11-4-3-9-19-11)17-14-12(13(15)18)5-2-8-16-14/h2-5,8-10H,6-7H2,1H3,(H2,15,18)(H,16,17)
InChIKeyYZKVHZVHPMYGPP-UHFFFAOYSA-N
XLogP2.21
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[1-(furan-2-yl)propan-2-ylamino]pyridine-3-carboxylate
CID 61042919
2-[2-(furan-2-yl)ethylamino]pyridine-3-carbothioamide
CID 54954281
2-(difluoromethylsulfanyl)-N-[4-(furan-2-yl)butan-2-yl]pyridine-3-carboxamide
CID 24641935
6-chloro-2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxylic acid
CID 63379862
N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine
CID 62482242
2-(3-aminobutylamino)pyridine-3-carboxamide
CID 63251486
2-amino-3-[4-(furan-2-yl)butan-2-ylamino]benzoic acid
CID 115545393
2-N-[4-(furan-2-yl)butan-2-yl]-3-methylpyridine-2,5-diamine
CID 55080552
N-[1-(furan-2-yl)propan-2-yl]-2-(methylamino)pyridine-3-carboxamide
CID 62180683
2-[(4-hydroxy-3-methylbutan-2-yl)amino]pyridine-3-carboxamide
CID 115643931
2-[1-(4-methylphenoxy)propan-2-ylamino]pyridine-3-carboxamide
CID 61166764
ethyl 4-[4-(furan-2-yl)butan-2-ylamino]-[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
CID 20947894

Frequently Asked Questions

What is the IUPAC name of 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide?
The IUPAC name of 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide (CID 60726854) is 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide?
The canonical SMILES for 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide is CC(CCc1ccco1)Nc1ncccc1C(N)=O.
What is the InChIKey of 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide?
The InChIKey is YZKVHZVHPMYGPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10(6-7-11-4-3-9-19-11)17-14-12(13(15)18)5-2-8-16-14/h2-5,8-10H,6-7H2,1H3,(H2,15,18)(H,16,17).
What are the key properties of 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide?
2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide is sourced from PubChem (CID 60726854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).