N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine

C12H23N — CID 130461635

IUPACN-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine
SMILESC/C=C\N(CC)C1(C)CCCCC1
InChIInChI=1S/C12H23N/c1-4-11-13(5-2)12(3)9-7-6-8-10-12/h4,11H,5-10H2,1-3H3/b11-4-
InChIKeyDOUHMHUJGRAAOZ-WCIBSUBMSA-N
MW181.32 g/mol
LogP3.56
Rot. Bonds3

About N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine

N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine (PubChem CID 130461635) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine
PubChem CID130461635
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC NameN-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine
SMILESC/C=C\N(CC)C1(C)CCCCC1
InChIInChI=1S/C12H23N/c1-4-11-13(5-2)12(3)9-7-6-8-10-12/h4,11H,5-10H2,1-3H3/b11-4-
InChIKeyDOUHMHUJGRAAOZ-WCIBSUBMSA-N
XLogP3.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine?
The IUPAC name of N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine (CID 130461635) is N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine?
The canonical SMILES for N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine is C/C=C\N(CC)C1(C)CCCCC1.
What is the InChIKey of N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine?
The InChIKey is DOUHMHUJGRAAOZ-WCIBSUBMSA-N. The full InChI is InChI=1S/C12H23N/c1-4-11-13(5-2)12(3)9-7-6-8-10-12/h4,11H,5-10H2,1-3H3/b11-4-.
What are the key properties of N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine?
N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine has a molecular weight of 181.32 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methyl-N-[(Z)-prop-1-enyl]cyclohexan-1-amine is sourced from PubChem (CID 130461635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).