5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine

C19H23N7 — CID 177147584

IUPAC5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
SMILESCc1cc(C)c2c(N)nc(NCc3nc(C)c4c(n3)CCCC4)nc2n1
InChIInChI=1S/C19H23N7/c1-10-8-11(2)22-18-16(10)17(20)25-19(26-18)21-9-15-23-12(3)13-6-4-5-7-14(13)24-15/h8H,4-7,9H2,1-3H3,(H3,20,21,22,25,26)
InChIKeyAPPGUFDAEURXBN-UHFFFAOYSA-N
MW349.44 g/mol
LogP2.81
Rot. Bonds3

About 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine

5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine (PubChem CID 177147584) has the molecular formula C19H23N7 and a molecular weight of 349.44 g/mol. Its IUPAC name is 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
PubChem CID177147584
Molecular FormulaC19H23N7
Molecular Weight349.44 g/mol
Exact Mass349.20
IUPAC Name5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
SMILESCc1cc(C)c2c(N)nc(NCc3nc(C)c4c(n3)CCCC4)nc2n1
InChIInChI=1S/C19H23N7/c1-10-8-11(2)22-18-16(10)17(20)25-19(26-18)21-9-15-23-12(3)13-6-4-5-7-14(13)24-15/h8H,4-7,9H2,1-3H3,(H3,20,21,22,25,26)
InChIKeyAPPGUFDAEURXBN-UHFFFAOYSA-N
XLogP2.81
TPSA102.50 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.44
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 177147679
6-methyl-4-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]pyrimidine-2,4-diamine
CID 72936445
2-N-(azetidin-3-yl)-5,7-dimethylpyrido[2,3-d]pyrimidine-2,4-diamine
CID 176671441
5,7-dimethyl-2-N-[(3-methylsulfonylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 177147652
4-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]-6-[(3R)-oxolan-3-yl]pyrimidine-2,4-diamine
CID 126452686
(2S)-1-(3,5-dimethylpyrazol-1-yl)-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]propan-2-amine
CID 95201478
3-[2-methyl-6-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methylamino]pyrimidin-4-yl]cyclobutan-1-ol
CID 91773337
2-N-[(4-bromophenyl)methyl]-5,7-dimethylpyrido[2,3-d]pyrimidine-2,4-diamine;5,7-dimethyl-2-N-[[2-(trifluoromethyl)phenyl]methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 177147592
[4-[[4-[(4-amino-5,7-dimethylpyrido[2,3-d]pyrimidin-2-yl)amino]piperidin-1-yl]methyl]phenyl]methanol
CID 176671009
2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethanamine;dihydrochloride
CID 75530624
2-N-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-5,7-dimethylpyrido[2,3-d]pyrimidine-2,4-diamine
CID 176671273
12-N-(2-imidazol-1-ylethyl)-8-methyl-2,11,13-triazatricyclo[7.4.0.03,7]trideca-1(13),2,7,9,11-pentaene-10,12-diamine
CID 177147628

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine (CID 177147584) is 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine is Cc1cc(C)c2c(N)nc(NCc3nc(C)c4c(n3)CCCC4)nc2n1.
What is the InChIKey of 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is APPGUFDAEURXBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7/c1-10-8-11(2)22-18-16(10)17(20)25-19(26-18)21-9-15-23-12(3)13-6-4-5-7-14(13)24-15/h8H,4-7,9H2,1-3H3,(H3,20,21,22,25,26).
What are the key properties of 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 349.44 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2-N-[(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 177147584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).