1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine

C14H25NO — CID 102896557

IUPAC1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine
SMILESC1CCC2(CC1)CCC(CNCC1CC1)O2
InChIInChI=1S/C14H25NO/c1-2-7-14(8-3-1)9-6-13(16-14)11-15-10-12-4-5-12/h12-13,15H,1-11H2
InChIKeyVJQXMBCSUFFMRG-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.87
Rot. Bonds4

About 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine

1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine (PubChem CID 102896557) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine
PubChem CID102896557
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine
SMILESC1CCC2(CC1)CCC(CNCC1CC1)O2
InChIInChI=1S/C14H25NO/c1-2-7-14(8-3-1)9-6-13(16-14)11-15-10-12-4-5-12/h12-13,15H,1-11H2
InChIKeyVJQXMBCSUFFMRG-UHFFFAOYSA-N
XLogP2.87
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-N-{[(2R)-oxolan-2-yl]methyl}cyclohexan-1-amine
CID 40515069
1-Cyclohexyl-N-((tetrahydrofuran-2-yl)methyl)methanamine
CID 3144577
2,2,2-trifluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)ethanamine
CID 102896748
3,3,3-trifluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)propan-1-amine
CID 102897265
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-2-(2,2,2-trifluoroethoxy)ethanamine
CID 102897299
2,2-difluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)ethanamine
CID 102897656
4,4,4-trifluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-amine
CID 102897659
5,5,5-trifluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)pentan-1-amine
CID 102897661
4,4,4-trifluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-2-amine
CID 103524797
2-(2,2-difluoroethoxy)-N-(1-oxaspiro[4.5]decan-2-ylmethyl)ethanamine
CID 105910762
N-(1-oxaspiro[4.5]decan-2-ylmethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106212497
2,2,3,3-tetrafluoro-N-(1-oxaspiro[4.5]decan-2-ylmethyl)propan-1-amine
CID 106292007

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine?
The IUPAC name of 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine (CID 102896557) is 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine?
The canonical SMILES for 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine is C1CCC2(CC1)CCC(CNCC1CC1)O2.
What is the InChIKey of 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine?
The InChIKey is VJQXMBCSUFFMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-7-14(8-3-1)9-6-13(16-14)11-15-10-12-4-5-12/h12-13,15H,1-11H2.
What are the key properties of 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine?
1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine has a molecular weight of 223.36 g/mol, XLogP of 2.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)methanamine is sourced from PubChem (CID 102896557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).