2-(cyclohexylmethoxymethyl)prop-2-en-1-amine

C11H21NO — CID 103074735

IUPAC2-(cyclohexylmethoxymethyl)prop-2-en-1-amine
SMILESC=C(CN)COCC1CCCCC1
InChIInChI=1S/C11H21NO/c1-10(7-12)8-13-9-11-5-3-2-4-6-11/h11H,1-9,12H2
InChIKeyXUCVLATVQNYMQN-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.10
Rot. Bonds5

About 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine

2-(cyclohexylmethoxymethyl)prop-2-en-1-amine (PubChem CID 103074735) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound Name2-(cyclohexylmethoxymethyl)prop-2-en-1-amine
PubChem CID103074735
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-(cyclohexylmethoxymethyl)prop-2-en-1-amine
SMILESC=C(CN)COCC1CCCCC1
InChIInChI=1S/C11H21NO/c1-10(7-12)8-13-9-11-5-3-2-4-6-11/h11H,1-9,12H2
InChIKeyXUCVLATVQNYMQN-UHFFFAOYSA-N
XLogP2.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[2-(2-Methylprop-2-enoxy)cyclohexyl]methanamine
CID 65838526
4-(Cyclohexylmethoxy)but-2-en-1-amine
CID 77110349
2-[(4-Methylcyclohexyl)oxymethyl]prop-2-en-1-amine
CID 103074400
2-[(2-Ethylcyclohexyl)oxymethyl]prop-2-en-1-amine
CID 103074406
2-[(2-Methylcyclohexyl)oxymethyl]prop-2-en-1-amine
CID 103074413
N-methyl-2-[(2-methylcyclohexyl)oxymethyl]prop-2-en-1-amine
CID 103074414
2-(Heptoxymethyl)prop-2-en-1-amine
CID 103074513
2-(2-Ethylhexoxymethyl)prop-2-en-1-amine
CID 103074536
2-(2-ethylhexoxymethyl)-N-methylprop-2-en-1-amine
CID 103074537
2-[(3-Methylcyclohexyl)oxymethyl]prop-2-en-1-amine
CID 103074570
2-(cyclohexylmethoxymethyl)-N-ethylprop-2-en-1-amine
CID 103074730
2-(cyclohexylmethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074734

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine?
The IUPAC name of 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine (CID 103074735) is 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine.
What is the SMILES notation for 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine?
The canonical SMILES for 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine is C=C(CN)COCC1CCCCC1.
What is the InChIKey of 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine?
The InChIKey is XUCVLATVQNYMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(7-12)8-13-9-11-5-3-2-4-6-11/h11H,1-9,12H2.
What are the key properties of 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine?
2-(cyclohexylmethoxymethyl)prop-2-en-1-amine has a molecular weight of 183.29 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethoxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 103074735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).