6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine

C15H21N3 — CID 79514905

IUPAC6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC1CCCCC12CN=C(N)N2c1ccccc1
InChIInChI=1S/C15H21N3/c1-12-7-5-6-10-15(12)11-17-14(16)18(15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3,(H2,16,17)
InChIKeyXGEABLSAJJANAW-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.77
Rot. Bonds1

About 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine

6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 79514905) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID79514905
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCC1CCCCC12CN=C(N)N2c1ccccc1
InChIInChI=1S/C15H21N3/c1-12-7-5-6-10-15(12)11-17-14(16)18(15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3,(H2,16,17)
InChIKeyXGEABLSAJJANAW-UHFFFAOYSA-N
XLogP2.77
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 3241
Epinastine Hydrochloride
CID 157313
s-Triazine, 1,2-dihydro-1-(p-butylphenyl)-4,6-diamino-2,2-dimethyl-
CID 78387
1-(2,3-Dimethylphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine;hydrochloride
CID 44531873
1-(4-Ethylphenyl)-6,6-dimethyl-1,3,5-triazine-2,4-diamine
CID 427330
N''-Cyclohexyl-N-(2-methylphenyl)guanidine
CID 14771694
1-(3-Ethylphenyl)-6,6-dimethyl-1,6-dihydro-1,3,5-triazine-2,4-diamine
CID 16072558
Epinastine hydrobromide
CID 3061907
1,3-Bis(2,6-diisopropylphenyl)imidazolidin-2-ylidene
CID 10883669
6,6-Dimethyl-1-(2-methylphenyl)-1,6-dihydro-1,3,5-triazine-2,4-diamine
CID 6603415
1-(3-methylbutyl)-N-phenyl-4,5-dihydroimidazol-2-amine
CID 24856216
(5S)-5-benzyl-1-(3-methylpentyl)-N-phenyl-4,5-dihydroimidazol-2-amine
CID 24856245

Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 79514905) is 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine is CC1CCCCC12CN=C(N)N2c1ccccc1.
What is the InChIKey of 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is XGEABLSAJJANAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-12-7-5-6-10-15(12)11-17-14(16)18(15)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10-11H2,1H3,(H2,16,17).
What are the key properties of 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine?
6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 243.35 g/mol, XLogP of 2.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-phenyl-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 79514905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).