2-tert-butylcyclohexan-1-amine

C10H21N — CID 520760

IUPAC2-tert-butylcyclohexan-1-amine
SMILESCC(C)(C)C1CCCCC1N
InChIInChI=1S/C10H21N/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9H,4-7,11H2,1-3H3
InChIKeyGEYTUFUSXAMSQK-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.55
Rot. Bonds

About 2-tert-butylcyclohexan-1-amine

2-tert-butylcyclohexan-1-amine (PubChem CID 520760) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 2-tert-butylcyclohexan-1-amine.

Molecular Properties

Compound Name2-tert-butylcyclohexan-1-amine
PubChem CID520760
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name2-tert-butylcyclohexan-1-amine
SMILESCC(C)(C)C1CCCCC1N
InChIInChI=1S/C10H21N/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9H,4-7,11H2,1-3H3
InChIKeyGEYTUFUSXAMSQK-UHFFFAOYSA-N
XLogP2.55
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butylcyclohexan-1-amine?
The IUPAC name of 2-tert-butylcyclohexan-1-amine (CID 520760) is 2-tert-butylcyclohexan-1-amine.
What is the SMILES notation for 2-tert-butylcyclohexan-1-amine?
The canonical SMILES for 2-tert-butylcyclohexan-1-amine is CC(C)(C)C1CCCCC1N.
What is the InChIKey of 2-tert-butylcyclohexan-1-amine?
The InChIKey is GEYTUFUSXAMSQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9H,4-7,11H2,1-3H3.
What are the key properties of 2-tert-butylcyclohexan-1-amine?
2-tert-butylcyclohexan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.55, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butylcyclohexan-1-amine is sourced from PubChem (CID 520760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).