1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine

C14H25NO — CID 102899073

IUPAC1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine
SMILESNC(CCC1CCC2(CCCC2)O1)C1CC1
InChIInChI=1S/C14H25NO/c15-13(11-3-4-11)6-5-12-7-10-14(16-12)8-1-2-9-14/h11-13H,1-10,15H2
InChIKeyJFJWBVIMOSEZLX-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.00
Rot. Bonds4

About 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine

1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine (PubChem CID 102899073) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine
PubChem CID102899073
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine
SMILESNC(CCC1CCC2(CCCC2)O1)C1CC1
InChIInChI=1S/C14H25NO/c15-13(11-3-4-11)6-5-12-7-10-14(16-12)8-1-2-9-14/h11-13H,1-10,15H2
InChIKeyJFJWBVIMOSEZLX-UHFFFAOYSA-N
XLogP3.00
TPSA35.25 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 ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-Methyl-2-tetra-hydrofurfuryl)-2-aminocyclopentane
CID 13025932
3-Fluoro-3-[3-(oxolan-2-yl)propyl]cyclopentan-1-amine
CID 112565590
5-Methyl-1-(oxolan-2-yl)hexan-3-amine
CID 13029349
(2R)-1-[(6R)-4-oxaspiro[2.5]octan-6-yl]pentan-2-amine
CID 59201556
2-(5-Methyloxolan-2-yl)cyclopropan-1-amine
CID 80345640
(3S,6R)-6-[(2R)-butan-2-yl]-5-oxaspiro[2.4]heptan-2-amine
CID 163784968
2-(Oxolan-2-ylmethyl)cyclopentan-1-amine
CID 13025931
2-(Tetrahydrofuran-2-yl)cyclopentanamine
CID 45098422
1-Cyclopentyl-2-(oxolan-2-yl)ethanamine
CID 60818275
4-Ethyl-1-(oxolan-2-yl)octan-2-amine
CID 61672541
4-Methyl-1-(oxolan-2-yl)pentan-3-amine
CID 62549638
3-Methyl-4-(oxolan-2-yl)butan-2-amine
CID 62549810

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine?
The IUPAC name of 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine (CID 102899073) is 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine.
What is the SMILES notation for 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine?
The canonical SMILES for 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine is NC(CCC1CCC2(CCCC2)O1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine?
The InChIKey is JFJWBVIMOSEZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c15-13(11-3-4-11)6-5-12-7-10-14(16-12)8-1-2-9-14/h11-13H,1-10,15H2.
What are the key properties of 1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine?
1-cyclopropyl-3-(1-oxaspiro[4.4]nonan-2-yl)propan-1-amine has a molecular weight of 223.36 g/mol, XLogP of 3.00, 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[4.4]nonan-2-yl)propan-1-amine is sourced from PubChem (CID 102899073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).