N-[4-(2-methylcyclopentyl)phenyl]formamide

C13H17NO — CID 142068561

IUPACN-[4-(2-methylcyclopentyl)phenyl]formamide
SMILESCC1CCCC1c1ccc(NC=O)cc1
InChIInChI=1S/C13H17NO/c1-10-3-2-4-13(10)11-5-7-12(8-6-11)14-9-15/h5-10,13H,2-4H2,1H3,(H,14,15)
InChIKeyPVSCZRKEGWYJTQ-UHFFFAOYSA-N
MW203.29 g/mol
LogP3.16
Rot. Bonds3

About N-[4-(2-methylcyclopentyl)phenyl]formamide

N-[4-(2-methylcyclopentyl)phenyl]formamide (PubChem CID 142068561) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is N-[4-(2-methylcyclopentyl)phenyl]formamide.

Molecular Properties

Compound NameN-[4-(2-methylcyclopentyl)phenyl]formamide
PubChem CID142068561
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC NameN-[4-(2-methylcyclopentyl)phenyl]formamide
SMILESCC1CCCC1c1ccc(NC=O)cc1
InChIInChI=1S/C13H17NO/c1-10-3-2-4-13(10)11-5-7-12(8-6-11)14-9-15/h5-10,13H,2-4H2,1H3,(H,14,15)
InChIKeyPVSCZRKEGWYJTQ-UHFFFAOYSA-N
XLogP3.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

Isoproturon
CID 36679
N-(2,4-Dimethylphenyl)formamide
CID 92363
Formamide, N-(2-methylphenyl)-
CID 7202
Monodesmethylisoproturon
CID 182167
Acetamide, N-(4-butylphenyl)-
CID 77227
Didesmethylisoproturon
CID 185831
2'-Phenylformanilide
CID 219948
Benzenamine, N,4-dimethyl-
CID 12165
Carbamic acid, (4-butylphenyl)-, methyl ester
CID 2169720
4'-Methylformanilide
CID 76519
4'-tert-Butylacetanilide
CID 140672
3',4'-Formoxylidide
CID 241610

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methylcyclopentyl)phenyl]formamide?
The IUPAC name of N-[4-(2-methylcyclopentyl)phenyl]formamide (CID 142068561) is N-[4-(2-methylcyclopentyl)phenyl]formamide.
What is the SMILES notation for N-[4-(2-methylcyclopentyl)phenyl]formamide?
The canonical SMILES for N-[4-(2-methylcyclopentyl)phenyl]formamide is CC1CCCC1c1ccc(NC=O)cc1.
What is the InChIKey of N-[4-(2-methylcyclopentyl)phenyl]formamide?
The InChIKey is PVSCZRKEGWYJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-10-3-2-4-13(10)11-5-7-12(8-6-11)14-9-15/h5-10,13H,2-4H2,1H3,(H,14,15).
What are the key properties of N-[4-(2-methylcyclopentyl)phenyl]formamide?
N-[4-(2-methylcyclopentyl)phenyl]formamide has a molecular weight of 203.29 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methylcyclopentyl)phenyl]formamide is sourced from PubChem (CID 142068561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).