N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide

C16H16N4O3 — CID 3897368

IUPACN-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(-c2cnn(CCO)c2)nc1
InChIInChI=1S/C16H16N4O3/c21-6-5-20-11-13(9-19-20)15-4-3-12(8-17-15)16(22)18-10-14-2-1-7-23-14/h1-4,7-9,11,21H,5-6,10H2,(H,18,22)
InChIKeyRDHOWGDLUJMCTQ-UHFFFAOYSA-N
MW312.33 g/mol
LogP1.46
Rot. Bonds6

About N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide

N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide (PubChem CID 3897368) has the molecular formula C16H16N4O3 and a molecular weight of 312.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide
PubChem CID3897368
Molecular FormulaC16H16N4O3
Molecular Weight312.33 g/mol
Exact Mass312.12
IUPAC NameN-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(-c2cnn(CCO)c2)nc1
InChIInChI=1S/C16H16N4O3/c21-6-5-20-11-13(9-19-20)15-4-3-12(8-17-15)16(22)18-10-14-2-1-7-23-14/h1-4,7-9,11,21H,5-6,10H2,(H,18,22)
InChIKeyRDHOWGDLUJMCTQ-UHFFFAOYSA-N
XLogP1.46
TPSA93.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(furan-2-ylmethylcarbamoyl)pyrazol-1-yl]acetic acid
CID 19621941
N-benzyl-6-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 3916665
N-(furan-2-ylmethyl)-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 109247083
N-(furan-2-ylmethyl)pyridine-3-carboxamide
CID 1087305
N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
CID 9034607
N-(furan-2-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 109254918
N-(furan-2-ylmethyl)-1-methyl-4-[(1-methylpyrazole-4-carbonyl)amino]pyrazole-3-carboxamide
CID 19474684
4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984
N-(furan-2-ylmethyl)-3-(3-methylbutanoylamino)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
CID 44783089
N-(furan-2-ylmethyl)-2-(4-phenylpyrazol-1-yl)propanamide
CID 110210706
N-(furan-2-ylmethyl)-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 20959394
1-N,3-N-bis(furan-2-ylmethyl)benzene-1,3-dicarboxamide
CID 743261

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide (CID 3897368) is N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide is O=C(NCc1ccco1)c1ccc(-c2cnn(CCO)c2)nc1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide?
The InChIKey is RDHOWGDLUJMCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3/c21-6-5-20-11-13(9-19-20)15-4-3-12(8-17-15)16(22)18-10-14-2-1-7-23-14/h1-4,7-9,11,21H,5-6,10H2,(H,18,22).
What are the key properties of N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide?
N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide has a molecular weight of 312.33 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-[1-(2-hydroxyethyl)pyrazol-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 3897368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).