2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide

C12H13N3O2 — CID 62073819

IUPAC2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
SMILESCC(NC(=O)c1cccnc1N)c1ccco1
InChIInChI=1S/C12H13N3O2/c1-8(10-5-3-7-17-10)15-12(16)9-4-2-6-14-11(9)13/h2-8H,1H3,(H2,13,14)(H,15,16)
InChIKeyHAGLFAOMMMWTDK-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.75
Rot. Bonds3

About 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide

2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide (PubChem CID 62073819) has the molecular formula C12H13N3O2 and a molecular weight of 231.26 g/mol. Its IUPAC name is 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
PubChem CID62073819
Molecular FormulaC12H13N3O2
Molecular Weight231.26 g/mol
Exact Mass231.10
IUPAC Name2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
SMILESCC(NC(=O)c1cccnc1N)c1ccco1
InChIInChI=1S/C12H13N3O2/c1-8(10-5-3-7-17-10)15-12(16)9-4-2-6-14-11(9)13/h2-8H,1H3,(H2,13,14)(H,15,16)
InChIKeyHAGLFAOMMMWTDK-UHFFFAOYSA-N
XLogP1.75
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-(1-pyridin-4-ylethyl)pyridine-3-carboxamide
CID 55069299
N-[(1S)-1-(furan-2-yl)ethyl]-2-(methylamino)benzamide
CID 81399463
2-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 94338730
2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 18116836
2-amino-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-3-carboxamide
CID 106283558
3-amino-N-[(1R)-1-(furan-2-yl)ethyl]naphthalene-2-carboxamide
CID 81392741
5-amino-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
CID 81316387
4-amino-2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 43535392
N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 18116946
2-amino-N-tert-butylpyridine-3-carboxamide
CID 59768561
2-amino-N-heptan-2-ylpyridine-3-carboxamide
CID 62073629
4-chloro-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
CID 43399481

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide (CID 62073819) is 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide is CC(NC(=O)c1cccnc1N)c1ccco1.
What is the InChIKey of 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is HAGLFAOMMMWTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-8(10-5-3-7-17-10)15-12(16)9-4-2-6-14-11(9)13/h2-8H,1H3,(H2,13,14)(H,15,16).
What are the key properties of 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide?
2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 231.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 62073819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).