4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine

C15H25N — CID 138735982

IUPAC4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine
SMILESC/C=C\C1=C(/C=C\CC)CCC(N(C)C)C1
InChIInChI=1S/C15H25N/c1-5-7-9-13-10-11-15(16(3)4)12-14(13)8-6-2/h6-9,15H,5,10-12H2,1-4H3/b8-6-,9-7-
InChIKeyRWIHEYRGBWAUMK-VRHVFUOLSA-N
MW219.37 g/mol
LogP3.94
Rot. Bonds4

About 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine

4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine (PubChem CID 138735982) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine.

Molecular Properties

Compound Name4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine
PubChem CID138735982
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Name4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine
SMILESC/C=C\C1=C(/C=C\CC)CCC(N(C)C)C1
InChIInChI=1S/C15H25N/c1-5-7-9-13-10-11-15(16(3)4)12-14(13)8-6-2/h6-9,15H,5,10-12H2,1-4H3/b8-6-,9-7-
InChIKeyRWIHEYRGBWAUMK-VRHVFUOLSA-N
XLogP3.94
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine?
The IUPAC name of 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine (CID 138735982) is 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine.
What is the SMILES notation for 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine?
The canonical SMILES for 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine is C/C=C\C1=C(/C=C\CC)CCC(N(C)C)C1.
What is the InChIKey of 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine?
The InChIKey is RWIHEYRGBWAUMK-VRHVFUOLSA-N. The full InChI is InChI=1S/C15H25N/c1-5-7-9-13-10-11-15(16(3)4)12-14(13)8-6-2/h6-9,15H,5,10-12H2,1-4H3/b8-6-,9-7-.
What are the key properties of 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine?
4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine has a molecular weight of 219.37 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-but-1-enyl]-N,N-dimethyl-3-[(Z)-prop-1-enyl]cyclohex-3-en-1-amine is sourced from PubChem (CID 138735982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).