2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine

C19H29NO — CID 106200460

IUPAC2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine
SMILESCCNC1CCC(c2ccccc2)CC1OCCC1CC1
InChIInChI=1S/C19H29NO/c1-2-20-18-11-10-17(16-6-4-3-5-7-16)14-19(18)21-13-12-15-8-9-15/h3-7,15,17-20H,2,8-14H2,1H3
InChIKeyNEEVEJGGSNNDIF-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.12
Rot. Bonds7

About 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine

2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine (PubChem CID 106200460) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine
PubChem CID106200460
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC Name2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine
SMILESCCNC1CCC(c2ccccc2)CC1OCCC1CC1
InChIInChI=1S/C19H29NO/c1-2-20-18-11-10-17(16-6-4-3-5-7-16)14-19(18)21-13-12-15-8-9-15/h3-7,15,17-20H,2,8-14H2,1H3
InChIKeyNEEVEJGGSNNDIF-UHFFFAOYSA-N
XLogP4.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-phenyl-2-propylcyclohexan-1-amine
CID 55185589
N-ethyl-2-(4-methoxybutyl)-4-phenylcyclohexan-1-amine
CID 104648371
2-(2-cyclobutylethoxy)-N-ethyl-4-methylcyclohexan-1-amine
CID 114157425
2-(2-cyclopropylethoxy)-N-ethylcyclooctan-1-amine
CID 106200627
2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine
CID 106200788
N-ethyl-2-(3-methoxypropylsulfanyl)-4-phenylcyclohexan-1-amine
CID 64626468
N-ethyl-2-(2-methylpropylsulfinyl)-4-phenylcyclohexan-1-amine
CID 64652860
(4-propylcyclohexyl)benzene
CID 155887669
2-(2-cyclobutylethoxy)-N-ethylcyclooctan-1-amine
CID 106200977
4-tert-butyl-N-ethyl-2-phenoxycyclohexan-1-amine
CID 63474712
4-phenyl-2-(2-propoxyethoxy)cyclohexan-1-ol
CID 63684572
N-ethyl-2-octoxy-4-propylcyclohexan-1-amine
CID 63474035

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine (CID 106200460) is 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine is CCNC1CCC(c2ccccc2)CC1OCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine?
The InChIKey is NEEVEJGGSNNDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-2-20-18-11-10-17(16-6-4-3-5-7-16)14-19(18)21-13-12-15-8-9-15/h3-7,15,17-20H,2,8-14H2,1H3.
What are the key properties of 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine?
2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine has a molecular weight of 287.45 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-N-ethyl-4-phenylcyclohexan-1-amine is sourced from PubChem (CID 106200460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).