2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine

C14H27NO — CID 106200593

IUPAC2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine
SMILESCNC1CCC(C)(C)CC1OCCC1CC1
InChIInChI=1S/C14H27NO/c1-14(2)8-6-12(15-3)13(10-14)16-9-7-11-4-5-11/h11-13,15H,4-10H2,1-3H3
InChIKeyHVDBDAVQUFNLMD-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds5

About 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine

2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine (PubChem CID 106200593) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine
PubChem CID106200593
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine
SMILESCNC1CCC(C)(C)CC1OCCC1CC1
InChIInChI=1S/C14H27NO/c1-14(2)8-6-12(15-3)13(10-14)16-9-7-11-4-5-11/h11-13,15H,4-10H2,1-3H3
InChIKeyHVDBDAVQUFNLMD-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-cyclopropylethoxy)-4,4-dimethylcyclohexan-1-ol
CID 106203965
2-(3,3-dimethylbutoxy)-N-ethyl-4,4-dimethylcyclohexan-1-amine
CID 66231563
2-(cyclopentylmethoxy)-N-ethyl-4,4-dimethylcyclohexan-1-amine
CID 66321323
N-(2-methoxyethoxy)-2,4,4-trimethylcyclohexan-1-amine
CID 82714886
N-(cyclopropylmethyl)-2,4,4-trimethylcyclohexan-1-amine
CID 79670640
2-(2,2-difluoroethoxy)-4,4-dimethyl-N-propylcyclohexan-1-amine
CID 82003841
2-cyclohexylsulfanyl-N,4,4-trimethylcyclohexan-1-amine
CID 64634815
2-(2-cyclopropylethoxy)-N-ethylcyclododecan-1-amine
CID 106200788
2-(2-cyclopropylethoxy)-N-ethylcyclooctan-1-amine
CID 106200627
N-(2-cyclopropylethoxy)methanamine
CID 105427061
N-(cyclopentylmethyl)-2,4,4-trimethylcyclohexan-1-amine
CID 81321267
2-[2-(3-methoxypropoxy)ethoxy]-4,4-dimethylcyclohexan-1-amine
CID 103177313

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine?
The IUPAC name of 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine (CID 106200593) is 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine is CNC1CCC(C)(C)CC1OCCC1CC1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine?
The InChIKey is HVDBDAVQUFNLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-14(2)8-6-12(15-3)13(10-14)16-9-7-11-4-5-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine?
2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-N,4,4-trimethylcyclohexan-1-amine is sourced from PubChem (CID 106200593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).