2-amino-2-(3-methylcyclohexyl)acetamide

C9H18N2O — CID 64990710

IUPAC2-amino-2-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(C(N)C(N)=O)C1
InChIInChI=1S/C9H18N2O/c1-6-3-2-4-7(5-6)8(10)9(11)12/h6-8H,2-5,10H2,1H3,(H2,11,12)
InChIKeyBERMKDJKJVXDOA-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.63
Rot. Bonds2

About 2-amino-2-(3-methylcyclohexyl)acetamide

2-amino-2-(3-methylcyclohexyl)acetamide (PubChem CID 64990710) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 2-amino-2-(3-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-amino-2-(3-methylcyclohexyl)acetamide
PubChem CID64990710
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name2-amino-2-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(C(N)C(N)=O)C1
InChIInChI=1S/C9H18N2O/c1-6-3-2-4-7(5-6)8(10)9(11)12/h6-8H,2-5,10H2,1H3,(H2,11,12)
InChIKeyBERMKDJKJVXDOA-UHFFFAOYSA-N
XLogP0.63
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(3-methylcyclohexyl)acetamide?
The IUPAC name of 2-amino-2-(3-methylcyclohexyl)acetamide (CID 64990710) is 2-amino-2-(3-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-amino-2-(3-methylcyclohexyl)acetamide?
The canonical SMILES for 2-amino-2-(3-methylcyclohexyl)acetamide is CC1CCCC(C(N)C(N)=O)C1.
What is the InChIKey of 2-amino-2-(3-methylcyclohexyl)acetamide?
The InChIKey is BERMKDJKJVXDOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-6-3-2-4-7(5-6)8(10)9(11)12/h6-8H,2-5,10H2,1H3,(H2,11,12).
What are the key properties of 2-amino-2-(3-methylcyclohexyl)acetamide?
2-amino-2-(3-methylcyclohexyl)acetamide has a molecular weight of 170.26 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(3-methylcyclohexyl)acetamide is sourced from PubChem (CID 64990710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).