2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine

C16H25NO — CID 65313813

IUPAC2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine
SMILESCCC1CCCCC1(N)c1ccc(OC)cc1C
InChIInChI=1S/C16H25NO/c1-4-13-7-5-6-10-16(13,17)15-9-8-14(18-3)11-12(15)2/h8-9,11,13H,4-7,10,17H2,1-3H3
InChIKeyDKHITUIVRBELBE-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.76
Rot. Bonds3

About 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine

2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine (PubChem CID 65313813) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine
PubChem CID65313813
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine
SMILESCCC1CCCCC1(N)c1ccc(OC)cc1C
InChIInChI=1S/C16H25NO/c1-4-13-7-5-6-10-16(13,17)15-9-8-14(18-3)11-12(15)2/h8-9,11,13H,4-7,10,17H2,1-3H3
InChIKeyDKHITUIVRBELBE-UHFFFAOYSA-N
XLogP3.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-ol
CID 65313174
1-(4-methoxy-2-methylphenyl)-4,4-dimethylcycloheptan-1-amine
CID 65313238
1-(4-ethylcyclohexyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79233573
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
1-(4-methoxy-2-methylphenyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 65313131
2-(4-methoxy-2-methylphenyl)-2-methylazepane
CID 79118168
1-(1-isocyanatocyclopentyl)-4-methoxy-2-methylbenzene
CID 117334453
1-(4-methoxy-2-methylphenyl)-4,4-dimethylcycloheptan-1-ol
CID 65313647
(4bR,8aS,9S)-N-ethyl-3-methoxy-N,4b-dimethyl-6,7,8,8a,9,10-hexahydro-5H-phenanthren-9-amine
CID 155632379
1-[amino-(4-methoxy-2-methylphenyl)methyl]-N,N-dimethylcyclopentan-1-amine
CID 79070446
N-(2-ethylcyclohexyl)-4-methoxy-2-methylaniline
CID 63862489
1-(2,6-dimethoxyphenyl)-2-ethylcyclohexan-1-ol
CID 116809729

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine?
The IUPAC name of 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine (CID 65313813) is 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine?
The canonical SMILES for 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine is CCC1CCCCC1(N)c1ccc(OC)cc1C.
What is the InChIKey of 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine?
The InChIKey is DKHITUIVRBELBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-4-13-7-5-6-10-16(13,17)15-9-8-14(18-3)11-12(15)2/h8-9,11,13H,4-7,10,17H2,1-3H3.
What are the key properties of 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine?
2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine has a molecular weight of 247.38 g/mol, XLogP of 3.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-(4-methoxy-2-methylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 65313813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).