(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride

C14H19ClN2O — CID 155850679

IUPAC(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride
SMILESCN1CC[C@@]2(CNC[C@@H]2c2ccccc2)C1=O.Cl
InChIInChI=1S/C14H18N2O.ClH/c1-16-8-7-14(13(16)17)10-15-9-12(14)11-5-3-2-4-6-11;/h2-6,12,15H,7-10H2,1H3;1H/t12-,14+;/m1./s1
InChIKeyJDRXHLXHASTCQW-OJMBIDBESA-N
MW266.77 g/mol
LogP1.64
Rot. Bonds1

About (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride

(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride (PubChem CID 155850679) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride.

Molecular Properties

Compound Name(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride
PubChem CID155850679
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride
SMILESCN1CC[C@@]2(CNC[C@@H]2c2ccccc2)C1=O.Cl
InChIInChI=1S/C14H18N2O.ClH/c1-16-8-7-14(13(16)17)10-15-9-12(14)11-5-3-2-4-6-11;/h2-6,12,15H,7-10H2,1H3;1H/t12-,14+;/m1./s1
InChIKeyJDRXHLXHASTCQW-OJMBIDBESA-N
XLogP1.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5R,9R)-9-phenyl-2-prop-2-enyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride
CID 155836199
(5R,9R)-7-cyclopropylsulfonyl-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one
CID 124820093
(5R,9S)-2-methyl-7-(oxolan-3-yl)-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one
CID 134690512
(5S,9S)-2-methyl-9-phenyl-7-(pyridine-4-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 97471880
2-ethyl-4-phenyl-2,9-diazaspiro[4.5]decan-1-one
CID 71060331
(5R,9R)-2-methyl-7-[(2-methyl-1,3-thiazol-4-yl)methyl]-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one
CID 124817310
(4S)-2-methyl-8-(morpholine-4-carbonyl)-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
CID 97452819
(5R,9R)-2-methyl-9-phenyl-7-(1,3-thiazole-4-carbonyl)-2,7-diazaspiro[4.4]nonan-1-one
CID 124821965
4-phenyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decan-1-one
CID 155872026
6-benzyl-2-methyl-2,6,9-triazaspiro[4.5]decan-1-one
CID 170035629
(5S,6R)-7-methyl-6-phenyl-2,7-diazaspiro[4.4]nonane-1,3-dione
CID 124527239
(5S,7S)-2-methyl-7-phenyl-2-azaspiro[4.4]non-8-en-1-one
CID 135010487

Frequently Asked Questions

What is the IUPAC name of (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride?
The IUPAC name of (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride (CID 155850679) is (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride.
What is the SMILES notation for (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride?
The canonical SMILES for (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride is CN1CC[C@@]2(CNC[C@@H]2c2ccccc2)C1=O.Cl.
What is the InChIKey of (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride?
The InChIKey is JDRXHLXHASTCQW-OJMBIDBESA-N. The full InChI is InChI=1S/C14H18N2O.ClH/c1-16-8-7-14(13(16)17)10-15-9-12(14)11-5-3-2-4-6-11;/h2-6,12,15H,7-10H2,1H3;1H/t12-,14+;/m1./s1.
What are the key properties of (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride?
(5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride has a molecular weight of 266.77 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,9R)-2-methyl-9-phenyl-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride is sourced from PubChem (CID 155850679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).