3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine

C12H22N2 — CID 142973334

IUPAC3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine
SMILESC=C(C)NC1CCCC(C(=C)NC)C1
InChIInChI=1S/C12H22N2/c1-9(2)14-12-7-5-6-11(8-12)10(3)13-4/h11-14H,1,3,5-8H2,2,4H3
InChIKeyGFVCRFVIZPSMPN-UHFFFAOYSA-N
MW194.32 g/mol
LogP2.40
Rot. Bonds4

About 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine

3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine (PubChem CID 142973334) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine
PubChem CID142973334
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine
SMILESC=C(C)NC1CCCC(C(=C)NC)C1
InChIInChI=1S/C12H22N2/c1-9(2)14-12-7-5-6-11(8-12)10(3)13-4/h11-14H,1,3,5-8H2,2,4H3
InChIKeyGFVCRFVIZPSMPN-UHFFFAOYSA-N
XLogP2.40
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine?
The IUPAC name of 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine (CID 142973334) is 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine.
What is the SMILES notation for 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine?
The canonical SMILES for 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine is C=C(C)NC1CCCC(C(=C)NC)C1.
What is the InChIKey of 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine?
The InChIKey is GFVCRFVIZPSMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-9(2)14-12-7-5-6-11(8-12)10(3)13-4/h11-14H,1,3,5-8H2,2,4H3.
What are the key properties of 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine?
3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine has a molecular weight of 194.32 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(methylamino)ethenyl]-N-prop-1-en-2-ylcyclohexan-1-amine is sourced from PubChem (CID 142973334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).