N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine

C14H27NO — CID 102951750

IUPACN-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine
SMILESCCOCC(C)NC1CCC12CCCCC2
InChIInChI=1S/C14H27NO/c1-3-16-11-12(2)15-13-7-10-14(13)8-5-4-6-9-14/h12-13,15H,3-11H2,1-2H3
InChIKeyKMZLMRSKCGOFES-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.11
Rot. Bonds5

About N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine

N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine (PubChem CID 102951750) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine
PubChem CID102951750
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC NameN-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine
SMILESCCOCC(C)NC1CCC12CCCCC2
InChIInChI=1S/C14H27NO/c1-3-16-11-12(2)15-13-7-10-14(13)8-5-4-6-9-14/h12-13,15H,3-11H2,1-2H3
InChIKeyKMZLMRSKCGOFES-UHFFFAOYSA-N
XLogP3.11
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 ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methoxyethyl)-3,3-dimethylcyclohexan-1-amine
CID 64468633
4-tert-butyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 60733032
2-tert-butyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 63776665
4-(2-methylbutan-2-yl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 63826940
4,4-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 64416607
3,3-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 64468718
Cyclobutanemethanamine, 1-decyl-N-(2-methoxyethyl)-
CID 65196627
2,2-dimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]cyclohexan-1-amine
CID 79835912
N-[2-(2,2,2-trifluoroethoxy)ethyl]spiro[3.5]nonan-3-amine
CID 102951933
2-tert-butyl-N-[2-(2,2-difluoroethoxy)ethyl]cyclohexan-1-amine
CID 102977828
N-[2-(2,2-difluoroethoxy)ethyl]-2,2-dimethylcyclohexan-1-amine
CID 102978139
N-[2-(2,2-difluoroethoxy)ethyl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 103080975

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine (CID 102951750) is N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine is CCOCC(C)NC1CCC12CCCCC2.
What is the InChIKey of N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine?
The InChIKey is KMZLMRSKCGOFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-3-16-11-12(2)15-13-7-10-14(13)8-5-4-6-9-14/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine?
N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine has a molecular weight of 225.38 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)spiro[3.5]nonan-3-amine is sourced from PubChem (CID 102951750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).