N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide

C12H14N2O2 — CID 60704628

IUPACN-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)NC1(C#N)CCCC1
InChIInChI=1S/C12H14N2O2/c1-9-10(4-7-16-9)11(15)14-12(8-13)5-2-3-6-12/h4,7H,2-3,5-6H2,1H3,(H,14,15)
InChIKeyRJPBLEJDSQVVEZ-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.15
Rot. Bonds2

About N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide

N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide (PubChem CID 60704628) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide
PubChem CID60704628
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC NameN-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide
SMILESCc1occc1C(=O)NC1(C#N)CCCC1
InChIInChI=1S/C12H14N2O2/c1-9-10(4-7-16-9)11(15)14-12(8-13)5-2-3-6-12/h4,7H,2-3,5-6H2,1H3,(H,14,15)
InChIKeyRJPBLEJDSQVVEZ-UHFFFAOYSA-N
XLogP2.15
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(1-cyanocyclobutyl)furan-3-carboxamide
CID 106685763
N-(1-cyanocyclooctyl)furan-2-carboxamide
CID 54904517
2-[1-[(2-methylfuran-3-carbonyl)amino]cyclohexyl]acetic acid
CID 64671935
N-(1-carbamothioylcyclohexyl)-2-methylfuran-3-carboxamide
CID 61119738
N-(1-cyanocycloheptyl)-4-fluoro-2-methylbenzamide
CID 115746057
N-(1-cyanocycloheptyl)-2-fluoro-5-methylbenzamide
CID 62514137
N-(1-cyanocyclohexyl)-4-hydroxybenzamide
CID 60717123
N-(1-cyanocycloheptyl)furan-3-carboxamide
CID 54904387
N-(1-cyanocyclohexyl)-1,5-dimethylpyrazole-4-carboxamide
CID 60709599
2-methyl-2-[(2-methylfuran-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 120545136
2-amino-N-(1-cyanocyclohexyl)benzamide
CID 110474346
N-[(1-hydroxycyclobutyl)methyl]-2-methylfuran-3-carboxamide
CID 111444909

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide (CID 60704628) is N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide is Cc1occc1C(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide?
The InChIKey is RJPBLEJDSQVVEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-9-10(4-7-16-9)11(15)14-12(8-13)5-2-3-6-12/h4,7H,2-3,5-6H2,1H3,(H,14,15).
What are the key properties of N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide?
N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide has a molecular weight of 218.26 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-methylfuran-3-carboxamide is sourced from PubChem (CID 60704628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).