N-but-1-en-2-ylcyclohexanamine

C10H19N — CID 12705416

IUPACN-but-1-en-2-ylcyclohexanamine
SMILESC=C(CC)NC1CCCCC1
InChIInChI=1S/C10H19N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,2-8H2,1H3
InChIKeyUEWGAERGRSWVLK-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.83
Rot. Bonds3

About N-but-1-en-2-ylcyclohexanamine

N-but-1-en-2-ylcyclohexanamine (PubChem CID 12705416) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is N-but-1-en-2-ylcyclohexanamine.

Molecular Properties

Compound NameN-but-1-en-2-ylcyclohexanamine
PubChem CID12705416
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC NameN-but-1-en-2-ylcyclohexanamine
SMILESC=C(CC)NC1CCCCC1
InChIInChI=1S/C10H19N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,2-8H2,1H3
InChIKeyUEWGAERGRSWVLK-UHFFFAOYSA-N
XLogP2.83
TPSA12.03 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 ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-but-1-en-2-ylcyclohexanamine?
The IUPAC name of N-but-1-en-2-ylcyclohexanamine (CID 12705416) is N-but-1-en-2-ylcyclohexanamine.
What is the SMILES notation for N-but-1-en-2-ylcyclohexanamine?
The canonical SMILES for N-but-1-en-2-ylcyclohexanamine is C=C(CC)NC1CCCCC1.
What is the InChIKey of N-but-1-en-2-ylcyclohexanamine?
The InChIKey is UEWGAERGRSWVLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-3-9(2)11-10-7-5-4-6-8-10/h10-11H,2-8H2,1H3.
What are the key properties of N-but-1-en-2-ylcyclohexanamine?
N-but-1-en-2-ylcyclohexanamine has a molecular weight of 153.27 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-but-1-en-2-ylcyclohexanamine is sourced from PubChem (CID 12705416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).