(1-butan-2-yloxycyclohexyl)methanamine

C11H23NO — CID 62108209

IUPAC(1-butan-2-yloxycyclohexyl)methanamine
SMILESCCC(C)OC1(CN)CCCCC1
InChIInChI=1S/C11H23NO/c1-3-10(2)13-11(9-12)7-5-4-6-8-11/h10H,3-9,12H2,1-2H3
InChIKeyQHDGCRAITDAJFG-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.46
Rot. Bonds4

About (1-butan-2-yloxycyclohexyl)methanamine

(1-butan-2-yloxycyclohexyl)methanamine (PubChem CID 62108209) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is (1-butan-2-yloxycyclohexyl)methanamine.

Molecular Properties

Compound Name(1-butan-2-yloxycyclohexyl)methanamine
PubChem CID62108209
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name(1-butan-2-yloxycyclohexyl)methanamine
SMILESCCC(C)OC1(CN)CCCCC1
InChIInChI=1S/C11H23NO/c1-3-10(2)13-11(9-12)7-5-4-6-8-11/h10H,3-9,12H2,1-2H3
InChIKeyQHDGCRAITDAJFG-UHFFFAOYSA-N
XLogP2.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (1-butan-2-yloxycyclohexyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Cyclohexyl-2-methoxyethan-1-amine
CID 57016644
(1-Methoxy-4-methylcyclohexyl)methanamine
CID 15495983
2-[(2-Methylcyclohexyl)oxy]ethan-1-amine
CID 20114360
(4-Ethoxycyclohexyl)methanamine
CID 57553441
(1-Methoxycyclohexyl)methanamine hydrochloride
CID 66589196
(1-Oxaspiro[4.5]decan-2-yl)methanamine
CID 86775345
(1-Ethoxycyclopentyl)methanamine
CID 62106387
2-Cyclohexyl-2-ethoxyethan-1-amine
CID 66073405
(6,6-Dimethyloxan-2-yl)methanamine
CID 130172828
(1-Methoxycyclohexyl)methanamine
CID 15495971
1-(3,3-Dimethyloxan-2-yl)methanamine
CID 138027445
2-(2-Ethylhexoxy)propan-1-amine
CID 53749876

Frequently Asked Questions

What is the IUPAC name of (1-butan-2-yloxycyclohexyl)methanamine?
The IUPAC name of (1-butan-2-yloxycyclohexyl)methanamine (CID 62108209) is (1-butan-2-yloxycyclohexyl)methanamine.
What is the SMILES notation for (1-butan-2-yloxycyclohexyl)methanamine?
The canonical SMILES for (1-butan-2-yloxycyclohexyl)methanamine is CCC(C)OC1(CN)CCCCC1.
What is the InChIKey of (1-butan-2-yloxycyclohexyl)methanamine?
The InChIKey is QHDGCRAITDAJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-10(2)13-11(9-12)7-5-4-6-8-11/h10H,3-9,12H2,1-2H3.
What are the key properties of (1-butan-2-yloxycyclohexyl)methanamine?
(1-butan-2-yloxycyclohexyl)methanamine has a molecular weight of 185.31 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-butan-2-yloxycyclohexyl)methanamine is sourced from PubChem (CID 62108209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).