N,N-dibenzylcyclohexanecarboxamide

C21H25NO — CID 1371794

IUPACN,N-dibenzylcyclohexanecarboxamide
SMILESO=C(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H25NO/c23-21(20-14-8-3-9-15-20)22(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyVIZLFTUJBQONSW-UHFFFAOYSA-N
MW307.44 g/mol
LogP4.80
Rot. Bonds5

About N,N-dibenzylcyclohexanecarboxamide

N,N-dibenzylcyclohexanecarboxamide (PubChem CID 1371794) has the molecular formula C21H25NO and a molecular weight of 307.44 g/mol. Its IUPAC name is N,N-dibenzylcyclohexanecarboxamide.

Molecular Properties

Compound NameN,N-dibenzylcyclohexanecarboxamide
PubChem CID1371794
Molecular FormulaC21H25NO
Molecular Weight307.44 g/mol
Exact Mass307.19
IUPAC NameN,N-dibenzylcyclohexanecarboxamide
SMILESO=C(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H25NO/c23-21(20-14-8-3-9-15-20)22(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyVIZLFTUJBQONSW-UHFFFAOYSA-N
XLogP4.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-aminoethyl)-N-benzylcycloheptanecarboxamide
CID 62585571
N-benzyl-N-ethylcyclobutanecarboxamide
CID 110755489
N-benzyl-N-(furan-2-ylmethyl)cyclopentanecarboxamide
CID 52894765
N-benzyl-N-[2-(dimethylamino)ethyl]cyclobutanecarboxamide
CID 78811308
N-benzylcyclopentanecarbohydrazide
CID 141018237
N,N-dibenzylpiperidine-3-carboxamide;hydrochloride
CID 119261732
N-(2-phenylethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]cyclohexanecarboxamide
CID 42698365
N-benzyl-N-[(E)-2-methyl-3-phenylprop-2-enyl]cyclopentanecarboxamide
CID 42697729
N-benzyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cyclopentanecarboxamide
CID 110670044
benzyl(cyclohexylmethyl)carbamic acid
CID 57063774
N-benzyl-N-[2-(dimethylamino)ethyl]cyclopropanecarboxamide
CID 60666282
N-benzyl-N-(cyanomethyl)cyclopropanecarboxamide
CID 61035902

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylcyclohexanecarboxamide?
The IUPAC name of N,N-dibenzylcyclohexanecarboxamide (CID 1371794) is N,N-dibenzylcyclohexanecarboxamide.
What is the SMILES notation for N,N-dibenzylcyclohexanecarboxamide?
The canonical SMILES for N,N-dibenzylcyclohexanecarboxamide is O=C(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylcyclohexanecarboxamide?
The InChIKey is VIZLFTUJBQONSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO/c23-21(20-14-8-3-9-15-20)22(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2.
What are the key properties of N,N-dibenzylcyclohexanecarboxamide?
N,N-dibenzylcyclohexanecarboxamide has a molecular weight of 307.44 g/mol, XLogP of 4.80, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylcyclohexanecarboxamide is sourced from PubChem (CID 1371794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).