N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide

C15H21ClN2O — CID 43236492

IUPACN-(3-chlorophenyl)-2-(cycloheptylamino)acetamide
SMILESO=C(CNC1CCCCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c16-12-6-5-9-14(10-12)18-15(19)11-17-13-7-3-1-2-4-8-13/h5-6,9-10,13,17H,1-4,7-8,11H2,(H,18,19)
InChIKeyOGNZRSUINZDOAQ-UHFFFAOYSA-N
MW280.80 g/mol
LogP3.59
Rot. Bonds4

About N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide

N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide (PubChem CID 43236492) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(cycloheptylamino)acetamide
PubChem CID43236492
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-(3-chlorophenyl)-2-(cycloheptylamino)acetamide
SMILESO=C(CNC1CCCCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C15H21ClN2O/c16-12-6-5-9-14(10-12)18-15(19)11-17-13-7-3-1-2-4-8-13/h5-6,9-10,13,17H,1-4,7-8,11H2,(H,18,19)
InChIKeyOGNZRSUINZDOAQ-UHFFFAOYSA-N
XLogP3.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
3-[[2-(cyclohexylamino)acetyl]amino]-N-methylbenzamide
CID 54816300
methyl 3-[[2-(cyclohexylamino)acetyl]amino]benzoate
CID 1133399
2-(cyclooctylamino)-N-(3,4-difluorophenyl)acetamide
CID 9265327
N-(3-chlorophenyl)-2-(2-cyclopentyloxyanilino)acetamide
CID 52704421
N-(3-chlorophenyl)-3-cyclohexylpropanamide
CID 803651
2-(cyclopropylamino)-N-(3,5-dichlorophenyl)acetamide
CID 60647336
2-chloro-5-[[2-(cyclopentylamino)acetyl]amino]benzoic acid
CID 60851750
N-[2-(3-chloroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997859
2-(cyclopentylamino)-N-[3-(methoxymethyl)phenyl]acetamide
CID 60847107
2-(cyclopentylamino)-N-[3-(difluoromethoxy)phenyl]acetamide
CID 60849036
N-tert-butyl-3-[[2-(cyclohexylamino)acetyl]amino]benzamide
CID 54816609

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide (CID 43236492) is N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide is O=C(CNC1CCCCCC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide?
The InChIKey is OGNZRSUINZDOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c16-12-6-5-9-14(10-12)18-15(19)11-17-13-7-3-1-2-4-8-13/h5-6,9-10,13,17H,1-4,7-8,11H2,(H,18,19).
What are the key properties of N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide?
N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide has a molecular weight of 280.80 g/mol, XLogP of 3.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(cycloheptylamino)acetamide is sourced from PubChem (CID 43236492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).