(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine

C12H23N — CID 118983531

IUPAC(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine
SMILESC/C=C\N(C)CC1CCC(C)CC1
InChIInChI=1S/C12H23N/c1-4-9-13(3)10-12-7-5-11(2)6-8-12/h4,9,11-12H,5-8,10H2,1-3H3/b9-4-
InChIKeyNEHVVWNGXGWXEZ-WTKPLQERSA-N
MW181.32 g/mol
LogP3.28
Rot. Bonds3

About (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine

(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine (PubChem CID 118983531) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine
PubChem CID118983531
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine
SMILESC/C=C\N(C)CC1CCC(C)CC1
InChIInChI=1S/C12H23N/c1-4-9-13(3)10-12-7-5-11(2)6-8-12/h4,9,11-12H,5-8,10H2,1-3H3/b9-4-
InChIKeyNEHVVWNGXGWXEZ-WTKPLQERSA-N
XLogP3.28
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 ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 53867295
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CID 89708389
CID 89708389
CID 91055826
CID 91055826
CID 118697908
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CID 123346281
CID 123346281
CID 123705181
CID 123705181
CID 123754105
CID 123754105
CID 130461635
CID 130461635
CID 134219252
CID 134219252

Frequently Asked Questions

What is the IUPAC name of (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine?
The IUPAC name of (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine (CID 118983531) is (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine?
The canonical SMILES for (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine is C/C=C\N(C)CC1CCC(C)CC1.
What is the InChIKey of (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine?
The InChIKey is NEHVVWNGXGWXEZ-WTKPLQERSA-N. The full InChI is InChI=1S/C12H23N/c1-4-9-13(3)10-12-7-5-11(2)6-8-12/h4,9,11-12H,5-8,10H2,1-3H3/b9-4-.
What are the key properties of (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine?
(Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine has a molecular weight of 181.32 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methyl-N-[(4-methylcyclohexyl)methyl]prop-1-en-1-amine is sourced from PubChem (CID 118983531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).