N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide

C20H21N3O2 — CID 95379084

IUPACN-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
SMILESO=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2cccn2)o1
InChIInChI=1S/C20H21N3O2/c24-19(18-10-9-17(25-18)15-23-14-6-13-21-23)22-20(11-4-5-12-20)16-7-2-1-3-8-16/h1-3,6-10,13-14H,4-5,11-12,15H2,(H,22,24)
InChIKeyRVLAXWFVTPFDBR-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.72
Rot. Bonds5

About N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide

N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide (PubChem CID 95379084) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
PubChem CID95379084
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC NameN-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
SMILESO=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2cccn2)o1
InChIInChI=1S/C20H21N3O2/c24-19(18-10-9-17(25-18)15-23-14-6-13-21-23)22-20(11-4-5-12-20)16-7-2-1-3-8-16/h1-3,6-10,13-14H,4-5,11-12,15H2,(H,22,24)
InChIKeyRVLAXWFVTPFDBR-UHFFFAOYSA-N
XLogP3.72
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(imidazol-1-ylmethyl)-N-(1-phenylcyclopentyl)furan-2-carboxamide
CID 86777635
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]-5-[(2-oxo-1-pyridinyl)methyl]furan-2-carboxamide
CID 78839450
2-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]propanoic acid
CID 43355239
N-ethoxy-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 60756494
N-(1,3-dihydroxypropan-2-yl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 65314941
3-hydroxy-2-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]propanoic acid
CID 43357614
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 95593404
N-butyl-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 19463195
5-bromo-N-(1-phenylcyclobutyl)furan-2-carboxamide
CID 51273024
N-[(1,3-dimethylpyrrolidin-3-yl)methyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 56861805
N-[(2-chlorophenyl)methyl]-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 39854547
N-(2,3-dihydroxy-2-methylpropyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 66170524

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide?
The IUPAC name of N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide (CID 95379084) is N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide.
What is the SMILES notation for N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide?
The canonical SMILES for N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide is O=C(NC1(c2ccccc2)CCCC1)c1ccc(Cn2cccn2)o1.
What is the InChIKey of N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide?
The InChIKey is RVLAXWFVTPFDBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c24-19(18-10-9-17(25-18)15-23-14-6-13-21-23)22-20(11-4-5-12-20)16-7-2-1-3-8-16/h1-3,6-10,13-14H,4-5,11-12,15H2,(H,22,24).
What are the key properties of N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide?
N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylcyclopentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide is sourced from PubChem (CID 95379084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).