4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine

C11H21NO — CID 114615823

IUPAC4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine
SMILESC=C(C)CNC1CCC(OC)CC1
InChIInChI=1S/C11H21NO/c1-9(2)8-12-10-4-6-11(13-3)7-5-10/h10-12H,1,4-8H2,2-3H3
InChIKeySJQZTLUHPNJIDL-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.11
Rot. Bonds4

About 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine

4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine (PubChem CID 114615823) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine
PubChem CID114615823
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine
SMILESC=C(C)CNC1CCC(OC)CC1
InChIInChI=1S/C11H21NO/c1-9(2)8-12-10-4-6-11(13-3)7-5-10/h10-12H,1,4-8H2,2-3H3
InChIKeySJQZTLUHPNJIDL-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.11
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

N-methyl-4-[6-[methyl(prop-2-enyl)amino]hexoxy]cyclohexan-1-amine
CID 11208331
trans-(4-[4-(Allyl-methyl-amino)-butoxy]-cyclohexyl)-methyl-amine
CID 22567622
N-methyl-4-[3-[methyl(prop-2-enyl)amino]propoxy]cyclohexan-1-amine
CID 22567695
N-ethyl-4-methoxycyclohexan-1-amine
CID 45090956
N-tert-butyl-4-methoxycyclohexan-1-amine
CID 45091383
N-tert-butyl-4-prop-2-enoxycyclohexan-1-amine
CID 60147274
N-propan-2-yl-4-propan-2-yloxycyclohexan-1-amine
CID 66605955
4-methoxy-N-propan-2-ylcyclohexan-1-amine
CID 66634340
N-Cyclohexyl-4-[(2-methylprop-2-en-1-yl)oxy]cyclohexan-1-amine
CID 67483354
N-hexyl-4-(2-methylprop-2-enoxy)cyclohexan-1-amine
CID 67485005
N-ethyl-4-methoxycyclohexan-1-amine;hydrochloride
CID 69830850
4-(3-aminoprop-1-en-2-yloxy)-N-methylcyclohexan-1-amine
CID 89294207

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine?
The IUPAC name of 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine (CID 114615823) is 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine.
What is the SMILES notation for 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine?
The canonical SMILES for 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine is C=C(C)CNC1CCC(OC)CC1.
What is the InChIKey of 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine?
The InChIKey is SJQZTLUHPNJIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-9(2)8-12-10-4-6-11(13-3)7-5-10/h10-12H,1,4-8H2,2-3H3.
What are the key properties of 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine?
4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine has a molecular weight of 183.29 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine is sourced from PubChem (CID 114615823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).