N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide

C14H16Cl2N2O2 — CID 78903583

IUPACN-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide
SMILESNC(=O)C1(NC(=O)c2cc(Cl)ccc2Cl)CCCCC1
InChIInChI=1S/C14H16Cl2N2O2/c15-9-4-5-11(16)10(8-9)12(19)18-14(13(17)20)6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H2,17,20)(H,18,19)
InChIKeyUKGLCJFHDHBOKS-UHFFFAOYSA-N
MW315.20 g/mol
LogP2.91
Rot. Bonds3

About N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide

N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide (PubChem CID 78903583) has the molecular formula C14H16Cl2N2O2 and a molecular weight of 315.20 g/mol. Its IUPAC name is N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide.

Molecular Properties

Compound NameN-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide
PubChem CID78903583
Molecular FormulaC14H16Cl2N2O2
Molecular Weight315.20 g/mol
Exact Mass314.06
IUPAC NameN-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide
SMILESNC(=O)C1(NC(=O)c2cc(Cl)ccc2Cl)CCCCC1
InChIInChI=1S/C14H16Cl2N2O2/c15-9-4-5-11(16)10(8-9)12(19)18-14(13(17)20)6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H2,17,20)(H,18,19)
InChIKeyUKGLCJFHDHBOKS-UHFFFAOYSA-N
XLogP2.91
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.20
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-carbamothioylcyclopentyl)-5-chloro-2-fluorobenzamide
CID 61119919
1-[(2,4-dichlorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43329570
N-[1-(bromomethyl)cyclopentyl]-2,5-dichlorobenzamide
CID 114311325
1-[(2-bromo-4-chlorobenzoyl)amino]cycloheptane-1-carboxylic acid
CID 107986460
(1-aminocyclohexyl)-(2,5-dichlorophenyl)methanone
CID 116550512
N-(1-carbamothioylcyclohexyl)-4-chloro-2,5-difluorobenzamide
CID 82772161
methyl 5-[(1-carbamoylcycloheptyl)carbamoylamino]-2-chlorobenzoate
CID 72889670
1-[(5-acetamido-2-chlorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 119350557
1-(2-chloroanilino)cyclooctane-1-carboxamide
CID 54892443
1-(2-chloroanilino)cycloheptane-1-carboxamide
CID 54892250
2,5-dichloro-N-[1-(3-chlorophenyl)cyclopropyl]benzamide
CID 110440796
N-(1-carbamoylcyclopentyl)-2-chlorocyclohepta-1,3,6-triene-1-carboxamide
CID 91393967

Frequently Asked Questions

What is the IUPAC name of N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide?
The IUPAC name of N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide (CID 78903583) is N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide.
What is the SMILES notation for N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide?
The canonical SMILES for N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide is NC(=O)C1(NC(=O)c2cc(Cl)ccc2Cl)CCCCC1.
What is the InChIKey of N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide?
The InChIKey is UKGLCJFHDHBOKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2O2/c15-9-4-5-11(16)10(8-9)12(19)18-14(13(17)20)6-2-1-3-7-14/h4-5,8H,1-3,6-7H2,(H2,17,20)(H,18,19).
What are the key properties of N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide?
N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide has a molecular weight of 315.20 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-carbamoylcyclohexyl)-2,5-dichlorobenzamide is sourced from PubChem (CID 78903583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).