1-(4-butylcyclohexyl)-N-ethylpropan-1-amine

C15H31N — CID 114979356

IUPAC1-(4-butylcyclohexyl)-N-ethylpropan-1-amine
SMILESCCCCC1CCC(C(CC)NCC)CC1
InChIInChI=1S/C15H31N/c1-4-7-8-13-9-11-14(12-10-13)15(5-2)16-6-3/h13-16H,4-12H2,1-3H3
InChIKeyBIDPNALUCWCKNY-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.37
Rot. Bonds7

About 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine

1-(4-butylcyclohexyl)-N-ethylpropan-1-amine (PubChem CID 114979356) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)-N-ethylpropan-1-amine
PubChem CID114979356
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name1-(4-butylcyclohexyl)-N-ethylpropan-1-amine
SMILESCCCCC1CCC(C(CC)NCC)CC1
InChIInChI=1S/C15H31N/c1-4-7-8-13-9-11-14(12-10-13)15(5-2)16-6-3/h13-16H,4-12H2,1-3H3
InChIKeyBIDPNALUCWCKNY-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-butylcyclohexyl)-N-ethyl-3-methylpentan-1-amine
CID 115846127
N-ethyl-1-(4-propylcyclohexyl)octan-1-amine
CID 65423776
1-(4-butylcyclohexyl)-N-ethyl-4-methylsulfonylbutan-1-amine
CID 115820297
1-(4-butylcyclohexyl)-N-ethyl-3-(oxolan-2-yl)propan-1-amine
CID 104993550
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
1-(4-butylcyclohexyl)-N,4-dimethylpentan-1-amine
CID 115834392
(4-butylcyclohexyl)-cyclopropylmethanamine
CID 104994185
1-(4-butylcyclohexyl)-N-methylethanamine
CID 115780857
1-(4-butylcyclohexyl)-3-methyl-N-propylbut-3-en-1-amine
CID 105004175
1-(4-butylcyclohexyl)but-3-ynylhydrazine
CID 105281413
3-cycloheptyl-1-cyclopropyl-N-ethylpropan-1-amine
CID 82924608
1-(4-butylcyclohexyl)-2-methyl-N-propylpropan-1-amine
CID 114978751

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine?
The IUPAC name of 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine (CID 114979356) is 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine.
What is the SMILES notation for 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine?
The canonical SMILES for 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine is CCCCC1CCC(C(CC)NCC)CC1.
What is the InChIKey of 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine?
The InChIKey is BIDPNALUCWCKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-4-7-8-13-9-11-14(12-10-13)15(5-2)16-6-3/h13-16H,4-12H2,1-3H3.
What are the key properties of 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine?
1-(4-butylcyclohexyl)-N-ethylpropan-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)-N-ethylpropan-1-amine is sourced from PubChem (CID 114979356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).