2-(3-aminocyclohexyl)-N-propan-2-ylacetamide

C11H22N2O — CID 62777908

IUPAC2-(3-aminocyclohexyl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CC1CCCC(N)C1
InChIInChI=1S/C11H22N2O/c1-8(2)13-11(14)7-9-4-3-5-10(12)6-9/h8-10H,3-7,12H2,1-2H3,(H,13,14)
InChIKeyVCAAHSVTYDAYOA-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.42
Rot. Bonds3

About 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide

2-(3-aminocyclohexyl)-N-propan-2-ylacetamide (PubChem CID 62777908) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)-N-propan-2-ylacetamide
PubChem CID62777908
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-(3-aminocyclohexyl)-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CC1CCCC(N)C1
InChIInChI=1S/C11H22N2O/c1-8(2)13-11(14)7-9-4-3-5-10(12)6-9/h8-10H,3-7,12H2,1-2H3,(H,13,14)
InChIKeyVCAAHSVTYDAYOA-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-aminocyclohexyl)-N-(4-methoxybutan-2-yl)acetamide
CID 64603511
2-(3-aminocyclohexyl)-N-[1-(dimethylamino)-4-methylpentan-2-yl]acetamide
CID 62782922
2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
2-(3-aminocyclohexyl)-N-(2,3,3-trimethylbutyl)acetamide
CID 83146431
2-(3-aminocyclohexyl)-N-[2-(methylamino)-2-oxoethyl]acetamide
CID 62783174
2-(3-aminocyclohexyl)-N-(2,2-dimethylpropyl)acetamide
CID 62782744
2-(3-aminocyclohexyl)-N-cyclooctylacetamide
CID 55116896
2-(3-aminocyclohexyl)-N-pentylacetamide
CID 62783155
2-[(3-aminocyclohexyl)-ethylamino]-N-propan-2-ylacetamide
CID 79468061
N-propan-2-yl-2-(thian-4-yl)acetamide
CID 80708318
N-[(3-aminocyclohexyl)methyl]-2-cyclohexylacetamide
CID 106123088
2-(3-aminocyclohexyl)-N-butan-2-yl-N-methylacetamide
CID 62781673

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide (CID 62777908) is 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide is CC(C)NC(=O)CC1CCCC(N)C1.
What is the InChIKey of 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide?
The InChIKey is VCAAHSVTYDAYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-8(2)13-11(14)7-9-4-3-5-10(12)6-9/h8-10H,3-7,12H2,1-2H3,(H,13,14).
What are the key properties of 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide?
2-(3-aminocyclohexyl)-N-propan-2-ylacetamide has a molecular weight of 198.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclohexyl)-N-propan-2-ylacetamide is sourced from PubChem (CID 62777908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).