1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine

C15H27NO — CID 102899074

IUPAC1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine
SMILESNC(CCC1CCC2(CCCCC2)O1)C1CC1
InChIInChI=1S/C15H27NO/c16-14(12-4-5-12)7-6-13-8-11-15(17-13)9-2-1-3-10-15/h12-14H,1-11,16H2
InChIKeyUMSOPFQJDZAEMI-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.39
Rot. Bonds4

About 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine

1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine (PubChem CID 102899074) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine
PubChem CID102899074
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine
SMILESNC(CCC1CCC2(CCCCC2)O1)C1CC1
InChIInChI=1S/C15H27NO/c16-14(12-4-5-12)7-6-13-8-11-15(17-13)9-2-1-3-10-15/h12-14H,1-11,16H2
InChIKeyUMSOPFQJDZAEMI-UHFFFAOYSA-N
XLogP3.39
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Oxaspiro[4.5]decan-8-amine
CID 67070405
3-(Oxolan-2-yl)-1-[2-(trifluoromethyl)cyclohexyl]propan-1-amine
CID 105156916
1-(4,4-Difluorocyclohexyl)-3-(oxolan-2-yl)propan-1-amine
CID 105156948
3-(Oxolan-2-yl)-1-[3-(trifluoromethyl)cyclohexyl]propan-1-amine
CID 105156949
3-(Oxolan-2-yl)-1-[4-(trifluoromethyl)cyclohexyl]propan-1-amine
CID 105156990
4-Fluoro-4-[3-(oxolan-2-yl)propyl]cyclohexan-1-amine
CID 112562282
3-Fluoro-3-[3-(oxolan-2-yl)propyl]cyclohexan-1-amine
CID 112567380
2-(3,3-Difluorocyclohexyl)-1-(2-methyloxolan-3-yl)ethanamine
CID 114225873
2-(5-Cyclohexyloxolan-2-yl)ethanamine
CID 11506642
2-[5-(2-Cyclohexylethyl)oxolan-2-yl]ethanamine
CID 11701358
5-Methyl-1-(oxolan-2-yl)hexan-3-amine
CID 13029349
(2-Tert-butyl-1-oxaspiro[4.5]decan-3-yl)methanamine
CID 22079428

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine?
The IUPAC name of 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine (CID 102899074) is 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine?
The canonical SMILES for 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine is NC(CCC1CCC2(CCCCC2)O1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine?
The InChIKey is UMSOPFQJDZAEMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c16-14(12-4-5-12)7-6-13-8-11-15(17-13)9-2-1-3-10-15/h12-14H,1-11,16H2.
What are the key properties of 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine?
1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine has a molecular weight of 237.39 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propan-1-amine is sourced from PubChem (CID 102899074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).