N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine

C14H27NO — CID 62549830

IUPACN-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C)CC1CC1CCCO1
InChIInChI=1S/C14H27NO/c1-3-15-14-7-6-11(2)9-12(14)10-13-5-4-8-16-13/h11-15H,3-10H2,1-2H3
InChIKeyBQDRLXWEBARXNZ-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds4

About N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine

N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine (PubChem CID 62549830) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine
PubChem CID62549830
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C)CC1CC1CCCO1
InChIInChI=1S/C14H27NO/c1-3-15-14-7-6-11(2)9-12(14)10-13-5-4-8-16-13/h11-15H,3-10H2,1-2H3
InChIKeyBQDRLXWEBARXNZ-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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

2,4-dimethyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 63995122
N,4-diethyl-2-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62609986
N-ethyl-4-methyl-2-(1,4-oxazepan-4-ylmethyl)cyclohexan-1-amine
CID 62972825
2-(azepan-1-ylmethyl)-N-ethyl-4-methylcyclohexan-1-amine
CID 62616066
N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine
CID 66371197
2-[(4,4-dimethylazepan-1-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 65282251
2-[(2,5-dimethylmorpholin-4-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 62616102
2-[(3,5-difluorophenyl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 105404538
2,5-dimethyl-N-(oxan-2-ylmethyl)cyclohexan-1-amine
CID 64761101
3-ethyl-2-methyl-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
CID 64921005
2-[[ethyl(oxolan-2-ylmethyl)amino]methyl]-4-methylcyclohexan-1-ol
CID 62609399
2-methyl-3-(oxolan-2-ylmethyl)cyclopentan-1-amine
CID 64909404

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine (CID 62549830) is N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine is CCNC1CCC(C)CC1CC1CCCO1.
What is the InChIKey of N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is BQDRLXWEBARXNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-3-15-14-7-6-11(2)9-12(14)10-13-5-4-8-16-13/h11-15H,3-10H2,1-2H3.
What are the key properties of N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine?
N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 62549830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).