N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine

C20H28N6 — CID 3368645

IUPACN-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine
SMILESCc1cc2nc(NC3=NCN(C4CCCCC4)CN3)nc(C)c2cc1C
InChIInChI=1S/C20H28N6/c1-13-9-17-15(3)23-20(24-18(17)10-14(13)2)25-19-21-11-26(12-22-19)16-7-5-4-6-8-16/h9-10,16H,4-8,11-12H2,1-3H3,(H2,21,22,23,24,25)
InChIKeyWVLSNZDDRPMKDR-UHFFFAOYSA-N
MW352.49 g/mol
LogP3.48
Rot. Bonds2

About N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine

N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine (PubChem CID 3368645) has the molecular formula C20H28N6 and a molecular weight of 352.49 g/mol. Its IUPAC name is N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine.

Molecular Properties

Compound NameN-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine
PubChem CID3368645
Molecular FormulaC20H28N6
Molecular Weight352.49 g/mol
Exact Mass352.24
IUPAC NameN-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine
SMILESCc1cc2nc(NC3=NCN(C4CCCCC4)CN3)nc(C)c2cc1C
InChIInChI=1S/C20H28N6/c1-13-9-17-15(3)23-20(24-18(17)10-14(13)2)25-19-21-11-26(12-22-19)16-7-5-4-6-8-16/h9-10,16H,4-8,11-12H2,1-3H3,(H2,21,22,23,24,25)
InChIKeyWVLSNZDDRPMKDR-UHFFFAOYSA-N
XLogP3.48
TPSA65.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.49
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine with MolForge

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Related Compounds

N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6-dimethylquinazolin-2-amine
CID 663799
4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 939063
4,6,7-trimethyl-N-[3-(2-morpholin-4-ylethyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 664190
4,6,7-trimethyl-N-[3-(2-phenylethyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 1397245
N-[3-[2-(3,4-dimethoxyphenyl)ethyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]-4,6,7-trimethylquinazolin-2-amine
CID 17337058
N-(3-cycloheptyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4-methylbenzenesulfonamide
CID 7339714
N-(3-butyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6-dimethylquinazolin-2-amine
CID 17121800
6-methoxy-4-methyl-N-[3-(4-methylpiperazin-1-yl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 17228591
4,8-dimethyl-N-(3-propyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)quinazolin-2-amine
CID 17228617
N-(3-benzyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,8-trimethylquinazolin-2-amine
CID 17228652
methyl 2-[(5R)-6-oxo-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-5-yl]acetate
CID 30466117
6-methoxy-4-methyl-N-[3-(2-morpholin-4-ylethyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 1093178

Frequently Asked Questions

What is the IUPAC name of N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine?
The IUPAC name of N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine (CID 3368645) is N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine.
What is the SMILES notation for N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine?
The canonical SMILES for N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine is Cc1cc2nc(NC3=NCN(C4CCCCC4)CN3)nc(C)c2cc1C.
What is the InChIKey of N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine?
The InChIKey is WVLSNZDDRPMKDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N6/c1-13-9-17-15(3)23-20(24-18(17)10-14(13)2)25-19-21-11-26(12-22-19)16-7-5-4-6-8-16/h9-10,16H,4-8,11-12H2,1-3H3,(H2,21,22,23,24,25).
What are the key properties of N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine?
N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine has a molecular weight of 352.49 g/mol, XLogP of 3.48, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine is sourced from PubChem (CID 3368645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).