2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride

C9H19ClN2O — CID 66985507

IUPAC2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride
SMILESCNC(=O)C(N)C1CCCCC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-11-9(12)8(10)7-5-3-2-4-6-7;/h7-8H,2-6,10H2,1H3,(H,11,12);1H
InChIKeyPKPVJDGTMVAKEC-UHFFFAOYSA-N
MW206.72 g/mol
LogP1.06
Rot. Bonds2

About 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride

2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride (PubChem CID 66985507) has the molecular formula C9H19ClN2O and a molecular weight of 206.72 g/mol. Its IUPAC name is 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride
PubChem CID66985507
Molecular FormulaC9H19ClN2O
Molecular Weight206.72 g/mol
Exact Mass206.12
IUPAC Name2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride
SMILESCNC(=O)C(N)C1CCCCC1.Cl
InChIInChI=1S/C9H18N2O.ClH/c1-11-9(12)8(10)7-5-3-2-4-6-7;/h7-8H,2-6,10H2,1H3,(H,11,12);1H
InChIKeyPKPVJDGTMVAKEC-UHFFFAOYSA-N
XLogP1.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.72
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-cyclohexyl-N-methylacetamide
CID 66931955
(2S)-2-amino-N-cyclobutyl-2-cyclohexylacetamide
CID 70337031
2-amino-N-cyclopentyl-2-cyclopropylacetamide
CID 130870089
1-amino-1-cycloheptylpropan-2-one
CID 54549167
(1S)-1-amino-1-cyclohexylpropan-2-one
CID 59946338
2-cyclohexyl-N-methylpropanamide;ethane
CID 143855673
2-cyclohexyl-N-methylbutanamide;hydrochloride
CID 174608918
2-amino-N-cyclooctyl-2-(oxan-4-yl)acetamide;hydrochloride
CID 120783011
methyl (2S)-2-[[(2S)-2-amino-2-cyclohexylacetyl]amino]-2-cyclohexylacetate
CID 70702377
methyl (2S)-2-[[(2S)-2-amino-2-cyclohexylacetyl]amino]-3-hydroxypropanoate
CID 126679555
2-amino-N-(1-cyclopentylethyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120792981
3-amino-4-cyclohexyl-2-hydroxy-N-methylbutanamide
CID 14478229

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride?
The IUPAC name of 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride (CID 66985507) is 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride.
What is the SMILES notation for 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride?
The canonical SMILES for 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride is CNC(=O)C(N)C1CCCCC1.Cl.
What is the InChIKey of 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride?
The InChIKey is PKPVJDGTMVAKEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O.ClH/c1-11-9(12)8(10)7-5-3-2-4-6-7;/h7-8H,2-6,10H2,1H3,(H,11,12);1H.
What are the key properties of 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride?
2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride has a molecular weight of 206.72 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-cyclohexyl-N-methylacetamide;hydrochloride is sourced from PubChem (CID 66985507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).