2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane

C15H22N2 — CID 163257013

IUPAC2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane
SMILESCc1ccc(N2CCC3(CC2)CN(C)C3)cc1
InChIInChI=1S/C15H22N2/c1-13-3-5-14(6-4-13)17-9-7-15(8-10-17)11-16(2)12-15/h3-6H,7-12H2,1-2H3
InChIKeyWNZNOUVJHDXKTG-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.53
Rot. Bonds1

About 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane

2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane (PubChem CID 163257013) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane
PubChem CID163257013
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC Name2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane
SMILESCc1ccc(N2CCC3(CC2)CN(C)C3)cc1
InChIInChI=1S/C15H22N2/c1-13-3-5-14(6-4-13)17-9-7-15(8-10-17)11-16(2)12-15/h3-6H,7-12H2,1-2H3
InChIKeyWNZNOUVJHDXKTG-UHFFFAOYSA-N
XLogP2.53
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane 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

4,4-difluoro-1-(4-methylphenyl)piperidine;ethane
CID 145061539
2-methyl-6-[[4-(4-methylphenyl)piperazin-1-yl]methyl]-2-azaspiro[3.3]heptane
CID 171429485
1-methyl-4-(4-methylphenyl)-1,4-diazocane
CID 143370715
2-(2-methyl-2,7-diazaspiro[3.5]nonan-7-yl)-7-[4-[1-(4-methylphenyl)cyclobutyl]phenyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 176625965
ethane;1-methyl-4-(4-methylphenyl)piperazine;1-(4-methylphenyl)piperidine
CID 143579449
2-methyl-7-[4-methyl-2-(2,2,2-trifluoroethyl)phenyl]-2,7-diazaspiro[3.5]nonane
CID 166899268
2-[[1-(4-methylphenyl)piperidin-4-yl]methyl]-2-azaspiro[3.3]heptane
CID 171069524
2-(4-tert-butylphenyl)-8-methyl-2,8-diazaspiro[4.5]decane
CID 168755787
5-methyl-2-(4-methylphenyl)-2,5-diazaspiro[3.5]nonane
CID 166899276
carbon dioxide;4-(4-methylphenyl)-1,4-thiazinane 1,1-dioxide
CID 160755106
2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane
CID 171070249
16-(4-methylphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71419396

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane (CID 163257013) is 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane is Cc1ccc(N2CCC3(CC2)CN(C)C3)cc1.
What is the InChIKey of 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane?
The InChIKey is WNZNOUVJHDXKTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-13-3-5-14(6-4-13)17-9-7-15(8-10-17)11-16(2)12-15/h3-6H,7-12H2,1-2H3.
What are the key properties of 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane?
2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane has a molecular weight of 230.36 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-(4-methylphenyl)-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 163257013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).