N-pent-1-en-2-ylcyclohexanamine

C11H21N — CID 71422454

IUPACN-pent-1-en-2-ylcyclohexanamine
SMILESC=C(CCC)NC1CCCCC1
InChIInChI=1S/C11H21N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h11-12H,2-9H2,1H3
InChIKeyRTZLNCPGJWOAMC-UHFFFAOYSA-N
MW167.30 g/mol
LogP3.22
Rot. Bonds4

About N-pent-1-en-2-ylcyclohexanamine

N-pent-1-en-2-ylcyclohexanamine (PubChem CID 71422454) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-pent-1-en-2-ylcyclohexanamine.

Molecular Properties

Compound NameN-pent-1-en-2-ylcyclohexanamine
PubChem CID71422454
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-pent-1-en-2-ylcyclohexanamine
SMILESC=C(CCC)NC1CCCCC1
InChIInChI=1S/C11H21N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h11-12H,2-9H2,1H3
InChIKeyRTZLNCPGJWOAMC-UHFFFAOYSA-N
XLogP3.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-pent-1-en-2-ylcyclohexanamine?
The IUPAC name of N-pent-1-en-2-ylcyclohexanamine (CID 71422454) is N-pent-1-en-2-ylcyclohexanamine.
What is the SMILES notation for N-pent-1-en-2-ylcyclohexanamine?
The canonical SMILES for N-pent-1-en-2-ylcyclohexanamine is C=C(CCC)NC1CCCCC1.
What is the InChIKey of N-pent-1-en-2-ylcyclohexanamine?
The InChIKey is RTZLNCPGJWOAMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h11-12H,2-9H2,1H3.
What are the key properties of N-pent-1-en-2-ylcyclohexanamine?
N-pent-1-en-2-ylcyclohexanamine has a molecular weight of 167.30 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pent-1-en-2-ylcyclohexanamine is sourced from PubChem (CID 71422454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).