N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide

C20H32N2O — CID 108993678

IUPACN-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide
SMILESCC(C)c1cccc(C(C)C)c1NCC(=O)NC1CCCCC1
InChIInChI=1S/C20H32N2O/c1-14(2)17-11-8-12-18(15(3)4)20(17)21-13-19(23)22-16-9-6-5-7-10-16/h8,11-12,14-16,21H,5-7,9-10,13H2,1-4H3,(H,22,23)
InChIKeyAWJNUXCXALTCMK-UHFFFAOYSA-N
MW316.49 g/mol
LogP4.79
Rot. Bonds6

About N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide

N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide (PubChem CID 108993678) has the molecular formula C20H32N2O and a molecular weight of 316.49 g/mol. Its IUPAC name is N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide
PubChem CID108993678
Molecular FormulaC20H32N2O
Molecular Weight316.49 g/mol
Exact Mass316.25
IUPAC NameN-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide
SMILESCC(C)c1cccc(C(C)C)c1NCC(=O)NC1CCCCC1
InChIInChI=1S/C20H32N2O/c1-14(2)17-11-8-12-18(15(3)4)20(17)21-13-19(23)22-16-9-6-5-7-10-16/h8,11-12,14-16,21H,5-7,9-10,13H2,1-4H3,(H,22,23)
InChIKeyAWJNUXCXALTCMK-UHFFFAOYSA-N
XLogP4.79
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.49
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-3-[2,6-di(propan-2-yl)anilino]propanamide
CID 109011766
N-cyclohexyl-2-(2,6-difluoroanilino)acetamide
CID 28879040
N-cyclopentyl-2-(2,6-difluoroanilino)acetamide
CID 28879037
N-cycloheptyl-3-(2-propan-2-ylanilino)propanamide
CID 109031466
N-cyclohexyl-3-(2-propan-2-ylanilino)propanamide
CID 109014020
N-cyclohexyl-2-(2-propan-2-ylphenoxy)acetamide
CID 725880
N-cycloheptyl-2-[[(1R)-1-(2-methylphenyl)ethyl]amino]acetamide
CID 81363494
N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]pyrimidine-5-carboxamide
CID 109250432
2-[1-(2-chlorophenyl)ethylamino]-N-cyclohexylacetamide
CID 51171753
N-cycloheptyl-2-[1-(2-fluorophenyl)ethylamino]acetamide
CID 60673176
[2-(cycloheptylamino)-2-oxoethyl] 2-(2-propan-2-ylphenoxy)acetate
CID 7903929
1-(4-cyclohexylcyclohexyl)-3-[2,6-di(propan-2-yl)phenyl]urea
CID 19935038

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide?
The IUPAC name of N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide (CID 108993678) is N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide?
The canonical SMILES for N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide is CC(C)c1cccc(C(C)C)c1NCC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide?
The InChIKey is AWJNUXCXALTCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2O/c1-14(2)17-11-8-12-18(15(3)4)20(17)21-13-19(23)22-16-9-6-5-7-10-16/h8,11-12,14-16,21H,5-7,9-10,13H2,1-4H3,(H,22,23).
What are the key properties of N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide?
N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide has a molecular weight of 316.49 g/mol, XLogP of 4.79, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[2,6-di(propan-2-yl)anilino]acetamide is sourced from PubChem (CID 108993678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).