N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide

C20H31N3O — CID 72939209

IUPACN,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide
SMILESCN1CC(c2ccccc2)CC2(CCN(CC(=O)N(C)C)CC2)C1
InChIInChI=1S/C20H31N3O/c1-21(2)19(24)15-23-11-9-20(10-12-23)13-18(14-22(3)16-20)17-7-5-4-6-8-17/h4-8,18H,9-16H2,1-3H3
InChIKeyOEEAQNQKQSINCK-UHFFFAOYSA-N
MW329.49 g/mol
LogP2.28
Rot. Bonds3

About N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide

N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide (PubChem CID 72939209) has the molecular formula C20H31N3O and a molecular weight of 329.49 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide
PubChem CID72939209
Molecular FormulaC20H31N3O
Molecular Weight329.49 g/mol
Exact Mass329.25
IUPAC NameN,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide
SMILESCN1CC(c2ccccc2)CC2(CCN(CC(=O)N(C)C)CC2)C1
InChIInChI=1S/C20H31N3O/c1-21(2)19(24)15-23-11-9-20(10-12-23)13-18(14-22(3)16-20)17-7-5-4-6-8-17/h4-8,18H,9-16H2,1-3H3
InChIKeyOEEAQNQKQSINCK-UHFFFAOYSA-N
XLogP2.28
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.49
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

AI3-37157
CID 760213
Piperidine, N-acetyl-4-benzyl-
CID 299608
1-Acetyl-4-(2,2-diphenylethyl)piperazine
CID 756869
N-((1-phenylcyclopentyl)methyl)-2-(piperidin-1-yl)acetamide hydrochloride
CID 16192743
1-(4-methylpiperazin-1-yl)-2-[[(1S,2R)-2-phenylcyclopropyl]amino]ethanone
CID 67379019
(4-Isopropylpiperazin-1-yl)(4-phenylpiperidin-1-yl)methanone
CID 44418498
N-methyl-4-phenyl-N-(2-(piperidin-1-yl)ethyl)piperidine-1-carboxamide
CID 44579389
1-(4-Methylpiperazin-1-yl)-2,3-diphenylpropan-1-one
CID 71449759
(2R)-1-(4-methylpiperazin-1-yl)-2,3-diphenylpropan-1-one
CID 71451571
1-(4-Ethylpiperazin-1-yl)-2,3-diphenylpropan-1-one
CID 71462300
N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(2-phenylethyl)propanamide
CID 162665076
2-(diethylamino)-N-[(1-phenylcyclopentyl)methyl]acetamide
CID 846518

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide?
The IUPAC name of N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide (CID 72939209) is N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide?
The canonical SMILES for N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide is CN1CC(c2ccccc2)CC2(CCN(CC(=O)N(C)C)CC2)C1.
What is the InChIKey of N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide?
The InChIKey is OEEAQNQKQSINCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N3O/c1-21(2)19(24)15-23-11-9-20(10-12-23)13-18(14-22(3)16-20)17-7-5-4-6-8-17/h4-8,18H,9-16H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide?
N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide has a molecular weight of 329.49 g/mol, XLogP of 2.28, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-methyl-4-phenyl-2,9-diazaspiro[5.5]undecan-9-yl)acetamide is sourced from PubChem (CID 72939209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).