N-(2-tert-butylphenyl)cyclopentanecarboxamide

C16H23NO — CID 7688669

IUPACN-(2-tert-butylphenyl)cyclopentanecarboxamide
SMILESCC(C)(C)c1ccccc1NC(=O)C1CCCC1
InChIInChI=1S/C16H23NO/c1-16(2,3)13-10-6-7-11-14(13)17-15(18)12-8-4-5-9-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,17,18)
InChIKeyMIHCWSMNBUURFJ-UHFFFAOYSA-N
MW245.37 g/mol
LogP4.11
Rot. Bonds2

About N-(2-tert-butylphenyl)cyclopentanecarboxamide

N-(2-tert-butylphenyl)cyclopentanecarboxamide (PubChem CID 7688669) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is N-(2-tert-butylphenyl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2-tert-butylphenyl)cyclopentanecarboxamide
PubChem CID7688669
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC NameN-(2-tert-butylphenyl)cyclopentanecarboxamide
SMILESCC(C)(C)c1ccccc1NC(=O)C1CCCC1
InChIInChI=1S/C16H23NO/c1-16(2,3)13-10-6-7-11-14(13)17-15(18)12-8-4-5-9-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,17,18)
InChIKeyMIHCWSMNBUURFJ-UHFFFAOYSA-N
XLogP4.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N-(2-tert-butylphenyl)-4-N-propan-2-ylcyclohexane-1,4-dicarboxamide
CID 109144561
N-(2-tert-butylphenyl)-1-methylpiperidine-4-carboxamide
CID 110693521
1-acetyl-N-(2-tert-butylphenyl)piperidine-4-carboxamide
CID 110686050
N-[2-(2-tert-butylanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997525
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
CID 837694
2-[(2-tert-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 22688945
N-(2-tert-butylphenyl)-1-methylpiperidine-2-carboxamide
CID 110858395
1-acetyl-N-(2-tert-butylphenyl)piperidine-3-carboxamide
CID 110686139
N-[6-(2-tert-butylanilino)pyridazin-3-yl]cyclobutanecarboxamide
CID 113047094
(2R)-N-(2-tert-butylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119399894
N-(2-tert-butylphenyl)-6-oxopiperidine-3-carboxamide
CID 76871965
1-N-tert-butyl-2-N-(2-tert-butylphenyl)cyclopropane-1,2-dicarboxamide
CID 109139608

Frequently Asked Questions

What is the IUPAC name of N-(2-tert-butylphenyl)cyclopentanecarboxamide?
The IUPAC name of N-(2-tert-butylphenyl)cyclopentanecarboxamide (CID 7688669) is N-(2-tert-butylphenyl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2-tert-butylphenyl)cyclopentanecarboxamide?
The canonical SMILES for N-(2-tert-butylphenyl)cyclopentanecarboxamide is CC(C)(C)c1ccccc1NC(=O)C1CCCC1.
What is the InChIKey of N-(2-tert-butylphenyl)cyclopentanecarboxamide?
The InChIKey is MIHCWSMNBUURFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-16(2,3)13-10-6-7-11-14(13)17-15(18)12-8-4-5-9-12/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,17,18).
What are the key properties of N-(2-tert-butylphenyl)cyclopentanecarboxamide?
N-(2-tert-butylphenyl)cyclopentanecarboxamide has a molecular weight of 245.37 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-tert-butylphenyl)cyclopentanecarboxamide is sourced from PubChem (CID 7688669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).