4-cyclohexylbut-1-en-1-amine

C10H19N — CID 70040289

IUPAC4-cyclohexylbut-1-en-1-amine
SMILESNC=CCCC1CCCCC1
InChIInChI=1S/C10H19N/c11-9-5-4-8-10-6-2-1-3-7-10/h5,9-10H,1-4,6-8,11H2
InChIKeyQKVVVELCKCJRSP-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.82
Rot. Bonds3

About 4-cyclohexylbut-1-en-1-amine

4-cyclohexylbut-1-en-1-amine (PubChem CID 70040289) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 4-cyclohexylbut-1-en-1-amine.

Molecular Properties

Compound Name4-cyclohexylbut-1-en-1-amine
PubChem CID70040289
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name4-cyclohexylbut-1-en-1-amine
SMILESNC=CCCC1CCCCC1
InChIInChI=1S/C10H19N/c11-9-5-4-8-10-6-2-1-3-7-10/h5,9-10H,1-4,6-8,11H2
InChIKeyQKVVVELCKCJRSP-UHFFFAOYSA-N
XLogP2.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexylbut-1-en-1-amine?
The IUPAC name of 4-cyclohexylbut-1-en-1-amine (CID 70040289) is 4-cyclohexylbut-1-en-1-amine.
What is the SMILES notation for 4-cyclohexylbut-1-en-1-amine?
The canonical SMILES for 4-cyclohexylbut-1-en-1-amine is NC=CCCC1CCCCC1.
What is the InChIKey of 4-cyclohexylbut-1-en-1-amine?
The InChIKey is QKVVVELCKCJRSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c11-9-5-4-8-10-6-2-1-3-7-10/h5,9-10H,1-4,6-8,11H2.
What are the key properties of 4-cyclohexylbut-1-en-1-amine?
4-cyclohexylbut-1-en-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexylbut-1-en-1-amine is sourced from PubChem (CID 70040289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).