4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine

C19H26N6 — CID 939063

IUPAC4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
SMILESCc1nc(NC2=NCN([C@@H]3CCCC[C@H]3C)CN2)nc2ccccc12
InChIInChI=1S/C19H26N6/c1-13-7-3-6-10-17(13)25-11-20-18(21-12-25)24-19-22-14(2)15-8-4-5-9-16(15)23-19/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3,(H2,20,21,22,23,24)/t13-,17-/m1/s1
InChIKeyNEEOQUZPWWKPOF-CXAGYDPISA-N
MW338.46 g/mol
LogP3.11
Rot. Bonds2

About 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine

4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine (PubChem CID 939063) has the molecular formula C19H26N6 and a molecular weight of 338.46 g/mol. Its IUPAC name is 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine.

Molecular Properties

Compound Name4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
PubChem CID939063
Molecular FormulaC19H26N6
Molecular Weight338.46 g/mol
Exact Mass338.22
IUPAC Name4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
SMILESCc1nc(NC2=NCN([C@@H]3CCCC[C@H]3C)CN2)nc2ccccc12
InChIInChI=1S/C19H26N6/c1-13-7-3-6-10-17(13)25-11-20-18(21-12-25)24-19-22-14(2)15-8-4-5-9-16(15)23-19/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3,(H2,20,21,22,23,24)/t13-,17-/m1/s1
InChIKeyNEEOQUZPWWKPOF-CXAGYDPISA-N
XLogP3.11
TPSA65.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6-dimethylquinazolin-2-amine
CID 663799
N-(3-cyclohexyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6,7-trimethylquinazolin-2-amine
CID 3368645
N-[3-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]-1,3-benzoxazol-2-amine
CID 7642466
N-[3-[(1S,2R,3S)-2,3-dimethylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]-1,3-benzoxazol-2-amine
CID 11910406
4-methyl-N-[3-[(1R,2S)-2-methylcyclohexyl]-1,2,3,4-tetrahydro-1,3,5-triazine-3,5-diium-6-yl]quinazolin-2-amine
CID 11888904
N-[3-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide
CID 124907507
4,6,7-trimethyl-N-[3-(2-phenylethyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine
CID 1397245
N-cyclohexyl-4-methylquinazolin-2-amine
CID 118714792
N-[3-(2,3-dimethylcyclohexyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]-4-methylbenzenesulfonamide
CID 17336978
N-(3-butyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)-4,6-dimethylquinazolin-2-amine
CID 17121800
4,8-dimethyl-N-(3-propyl-2,4-dihydro-1H-1,3,5-triazin-6-yl)quinazolin-2-amine
CID 17228617
N-[3-(furan-2-ylmethyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]-4,6-dimethylquinazolin-2-amine
CID 944281

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine?
The IUPAC name of 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine (CID 939063) is 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine.
What is the SMILES notation for 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine?
The canonical SMILES for 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine is Cc1nc(NC2=NCN([C@@H]3CCCC[C@H]3C)CN2)nc2ccccc12.
What is the InChIKey of 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine?
The InChIKey is NEEOQUZPWWKPOF-CXAGYDPISA-N. The full InChI is InChI=1S/C19H26N6/c1-13-7-3-6-10-17(13)25-11-20-18(21-12-25)24-19-22-14(2)15-8-4-5-9-16(15)23-19/h4-5,8-9,13,17H,3,6-7,10-12H2,1-2H3,(H2,20,21,22,23,24)/t13-,17-/m1/s1.
What are the key properties of 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine?
4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine has a molecular weight of 338.46 g/mol, XLogP of 3.11, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[3-[(1R,2R)-2-methylcyclohexyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]quinazolin-2-amine is sourced from PubChem (CID 939063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).