2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one

C10H18N2O2 — CID 122238852

IUPAC2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one
SMILESCC(N)C(=O)N1CCC2(CC1)COC2
InChIInChI=1S/C10H18N2O2/c1-8(11)9(13)12-4-2-10(3-5-12)6-14-7-10/h8H,2-7,11H2,1H3
InChIKeyVQLOVJMTLPYXHL-UHFFFAOYSA-N
MW198.27 g/mol
LogP-0.03
Rot. Bonds1

About 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one

2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one (PubChem CID 122238852) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one.

Molecular Properties

Compound Name2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one
PubChem CID122238852
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one
SMILESCC(N)C(=O)N1CCC2(CC1)COC2
InChIInChI=1S/C10H18N2O2/c1-8(11)9(13)12-4-2-10(3-5-12)6-14-7-10/h8H,2-7,11H2,1H3
InChIKeyVQLOVJMTLPYXHL-UHFFFAOYSA-N
XLogP-0.03
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-1-(2-azaspiro[4.4]nonan-2-yl)propan-1-one
CID 130163238
(2R)-2-amino-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 156637014
(2R)-2-amino-1-(1,4,7-trioxa-10-azacyclododec-10-yl)propan-1-one
CID 1121708
2,2-dimethyl-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one
CID 126750142
(2S)-2-amino-1-(azetidin-1-yl)propan-1-one;hydrochloride
CID 53484456
2-amino-1-(azetidin-1-yl)propan-1-one;hydrochloride
CID 53484454
1-(7-azaspiro[3.5]nonan-7-yl)-2-methylpropan-1-one
CID 130721457
2-amino-1-(3-hydroxy-3-methylpyrrolidin-1-yl)propan-1-one
CID 103355859
(2S)-2-amino-1-[(5S,8S)-8-amino-2-azaspiro[4.4]nonan-2-yl]propan-1-one
CID 129373055
(2S)-2-amino-1-[(5R,8R)-8-amino-2-azaspiro[4.4]nonan-2-yl]propan-1-one
CID 98084178
(2S)-2-amino-1-(2,7-diazaspiro[4.4]nonan-2-yl)propan-1-one;hydrochloride
CID 130927327
2-amino-1-(2,2,6,6-tetramethylmorpholin-4-yl)propan-1-one
CID 102743719

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one?
The IUPAC name of 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one (CID 122238852) is 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one.
What is the SMILES notation for 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one?
The canonical SMILES for 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one is CC(N)C(=O)N1CCC2(CC1)COC2.
What is the InChIKey of 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one?
The InChIKey is VQLOVJMTLPYXHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-8(11)9(13)12-4-2-10(3-5-12)6-14-7-10/h8H,2-7,11H2,1H3.
What are the key properties of 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one?
2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one has a molecular weight of 198.27 g/mol, XLogP of -0.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-oxa-7-azaspiro[3.5]nonan-7-yl)propan-1-one is sourced from PubChem (CID 122238852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).