1-(diethylamino)cyclohexane-1-carboxamide

C11H22N2O — CID 16762798

IUPAC1-(diethylamino)cyclohexane-1-carboxamide
SMILESCCN(CC)C1(C(N)=O)CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-13(4-2)11(10(12)14)8-6-5-7-9-11/h3-9H2,1-2H3,(H2,12,14)
InChIKeyPNNVQZUPGMDTMK-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.52
Rot. Bonds4

About 1-(diethylamino)cyclohexane-1-carboxamide

1-(diethylamino)cyclohexane-1-carboxamide (PubChem CID 16762798) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(diethylamino)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(diethylamino)cyclohexane-1-carboxamide
PubChem CID16762798
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(diethylamino)cyclohexane-1-carboxamide
SMILESCCN(CC)C1(C(N)=O)CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-13(4-2)11(10(12)14)8-6-5-7-9-11/h3-9H2,1-2H3,(H2,12,14)
InChIKeyPNNVQZUPGMDTMK-UHFFFAOYSA-N
XLogP1.52
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(diethylamino)cyclododecane-1-carboxylic acid
CID 43803612
1-(diethylamino)cycloheptane-1-carboxylic acid
CID 43803613
1-[1-(diethylamino)cyclopentyl]propan-1-one
CID 79070006
[1-(diethylamino)cyclopentyl]-(oxan-4-yl)methanone
CID 79070861
1-[butyl(ethyl)amino]cycloheptane-1-carboxylic acid
CID 114991397
[1-(diethylamino)cyclopentyl]-(oxolan-3-yl)methanone
CID 79070012
[1-(diethylamino)cyclopentyl]-(3,5-dimethylcyclohexyl)methanone
CID 79069711
1-[ethyl(methyl)amino]cyclohexane-1-carboxylic acid
CID 82236408
3-[[1-(aminomethyl)cycloheptyl]-ethylamino]propanamide
CID 62008325
1-[ethyl(2-methoxyethyl)amino]cyclohexane-1-carboxylic acid
CID 114996679
1-ethylcyclopentane-1-carboxamide
CID 55285008
1-(diethylamino)-4-ethylcyclohexane-1-carboxylic acid
CID 43803655

Frequently Asked Questions

What is the IUPAC name of 1-(diethylamino)cyclohexane-1-carboxamide?
The IUPAC name of 1-(diethylamino)cyclohexane-1-carboxamide (CID 16762798) is 1-(diethylamino)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(diethylamino)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(diethylamino)cyclohexane-1-carboxamide is CCN(CC)C1(C(N)=O)CCCCC1.
What is the InChIKey of 1-(diethylamino)cyclohexane-1-carboxamide?
The InChIKey is PNNVQZUPGMDTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-13(4-2)11(10(12)14)8-6-5-7-9-11/h3-9H2,1-2H3,(H2,12,14).
What are the key properties of 1-(diethylamino)cyclohexane-1-carboxamide?
1-(diethylamino)cyclohexane-1-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(diethylamino)cyclohexane-1-carboxamide is sourced from PubChem (CID 16762798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).