2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine

C14H29NO — CID 62444152

IUPAC2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
SMILESCCC1CCCCC1OC(C)CNC(C)C
InChIInChI=1S/C14H29NO/c1-5-13-8-6-7-9-14(13)16-12(4)10-15-11(2)3/h11-15H,5-10H2,1-4H3
InChIKeyXRAJTBGTPSZIGZ-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.36
Rot. Bonds6

About 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine

2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine (PubChem CID 62444152) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
PubChem CID62444152
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
SMILESCCC1CCCCC1OC(C)CNC(C)C
InChIInChI=1S/C14H29NO/c1-5-13-8-6-7-9-14(13)16-12(4)10-15-11(2)3/h11-15H,5-10H2,1-4H3
InChIKeyXRAJTBGTPSZIGZ-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethylcyclohexyl)oxy-N-methylpropan-1-amine
CID 62443960
N-[2-(2-ethylcyclohexyl)oxypropyl]-2-methylpropan-2-amine
CID 55072973
2-(2-methylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine
CID 62444144
3-(2-ethylcyclohexyl)oxybutan-1-amine
CID 114995089
(2-ethylcyclohexyl) 2-aminopropanoate
CID 61277036
1-ethyl-2-hydroperoxycyclohexane
CID 175085860
N-[2-(2-ethylcyclohexyl)ethyl]propan-2-amine
CID 63861330
2-(2-methylcyclohexyl)oxy-N-propan-2-ylbutan-1-amine
CID 62444537
ethyl 2-(2-ethylcyclohexyl)oxy-2-fluoroacetate
CID 79356654
N-[(2-ethylcyclopentyl)methyl]propan-2-amine
CID 58787055
N-[[4-(2-ethylcyclohexyl)oxy-2-pyridinyl]methyl]propan-2-amine
CID 62290861
1-(2-ethylcyclohexyl)oxy-3-(hexan-2-ylamino)propan-2-ol
CID 62200593

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine (CID 62444152) is 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine is CCC1CCCCC1OC(C)CNC(C)C.
What is the InChIKey of 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine?
The InChIKey is XRAJTBGTPSZIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-5-13-8-6-7-9-14(13)16-12(4)10-15-11(2)3/h11-15H,5-10H2,1-4H3.
What are the key properties of 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine?
2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylcyclohexyl)oxy-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 62444152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).