3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine

C17H31NO — CID 66358779

IUPAC3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine
SMILESCCNC1CC(OC2CCCCC2)C12CCCCC2
InChIInChI=1S/C17H31NO/c1-2-18-15-13-16(17(15)11-7-4-8-12-17)19-14-9-5-3-6-10-14/h14-16,18H,2-13H2,1H3
InChIKeyBBAPISHSZACVAZ-UHFFFAOYSA-N
MW265.44 g/mol
LogP4.04
Rot. Bonds4

About 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine

3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine (PubChem CID 66358779) has the molecular formula C17H31NO and a molecular weight of 265.44 g/mol. Its IUPAC name is 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine.

Molecular Properties

Compound Name3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine
PubChem CID66358779
Molecular FormulaC17H31NO
Molecular Weight265.44 g/mol
Exact Mass265.24
IUPAC Name3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine
SMILESCCNC1CC(OC2CCCCC2)C12CCCCC2
InChIInChI=1S/C17H31NO/c1-2-18-15-13-16(17(15)11-7-4-8-12-17)19-14-9-5-3-6-10-14/h14-16,18H,2-13H2,1H3
InChIKeyBBAPISHSZACVAZ-UHFFFAOYSA-N
XLogP4.04
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-3-(4-methylcyclohexyl)oxyspiro[3.5]nonan-1-amine
CID 66359603
N-ethyl-3-heptoxyspiro[3.6]decan-1-amine
CID 66357419
N-ethyl-3-(3-methylbutoxy)spiro[3.6]decan-1-amine
CID 66357172
N-ethyl-3-(2-methylbutan-2-yloxy)spiro[3.4]octan-1-amine
CID 66359457
N-ethyl-3-pentoxyspiro[3.4]octan-1-amine
CID 66356663
N-ethyl-3-(3,3,3-trifluoropropoxy)spiro[3.6]decan-1-amine
CID 82956691
N-(2-cyclopentyloxyethyl)-3-ethoxyspiro[3.4]octan-1-amine
CID 64864059
N-ethyl-3-(4-methylpentoxy)spiro[3.5]nonan-1-amine
CID 66358237
N-ethyl-3-(3,3,3-trifluoropropoxy)spiro[3.5]nonan-1-amine
CID 82958075
N-methyl-3-(4-methylcyclohexyl)oxyspiro[3.6]decan-1-amine
CID 66357175
N-ethyl-3-[2-(2-methylpropoxy)ethoxy]spiro[3.5]nonan-1-amine
CID 106451100
3-(4,4-dimethylcyclohexyl)oxy-N-methylspiro[3.4]octan-1-amine
CID 114342840

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine?
The IUPAC name of 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine (CID 66358779) is 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine.
What is the SMILES notation for 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine?
The canonical SMILES for 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine is CCNC1CC(OC2CCCCC2)C12CCCCC2.
What is the InChIKey of 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine?
The InChIKey is BBAPISHSZACVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NO/c1-2-18-15-13-16(17(15)11-7-4-8-12-17)19-14-9-5-3-6-10-14/h14-16,18H,2-13H2,1H3.
What are the key properties of 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine?
3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine has a molecular weight of 265.44 g/mol, XLogP of 4.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-N-ethylspiro[3.5]nonan-1-amine is sourced from PubChem (CID 66358779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).