5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine

C16H21N7 — CID 177147679

IUPAC5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
SMILESCc1cc(C)c2c(N)nc(NCc3c(C)nn(C)c3C)nc2n1
InChIInChI=1S/C16H21N7/c1-8-6-9(2)19-15-13(8)14(17)20-16(21-15)18-7-12-10(3)22-23(5)11(12)4/h6H,7H2,1-5H3,(H3,17,18,19,20,21)
InChIKeyIHJGIGUPYWKATH-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.19
Rot. Bonds3

About 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine

5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine (PubChem CID 177147679) has the molecular formula C16H21N7 and a molecular weight of 311.39 g/mol. Its IUPAC name is 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
PubChem CID177147679
Molecular FormulaC16H21N7
Molecular Weight311.39 g/mol
Exact Mass311.19
IUPAC Name5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
SMILESCc1cc(C)c2c(N)nc(NCc3c(C)nn(C)c3C)nc2n1
InChIInChI=1S/C16H21N7/c1-8-6-9(2)19-15-13(8)14(17)20-16(21-15)18-7-12-10(3)22-23(5)11(12)4/h6H,7H2,1-5H3,(H3,17,18,19,20,21)
InChIKeyIHJGIGUPYWKATH-UHFFFAOYSA-N
XLogP2.19
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

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
3-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazine-2,3-diamine
CID 113243769
4-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidin-2-amine
CID 78995441
5,7-dimethyl-2-N-[(3-methylsulfonylphenyl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine
CID 177147652
6-chloro-4-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-2,4-diamine
CID 78990644
4-bromo-2,6-dimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline
CID 54863746
4-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidine-4,6-diamine
CID 80848172
4-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
CID 79242424
5-chloro-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrimidin-2-amine
CID 79556372
2,5-dichloro-4-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]aniline
CID 115755792
2-N,2-N,6-N-trimethyl-4-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80835200
4-[(1,3,5-trimethylpyrazol-4-yl)methylamino]benzenesulfonamide
CID 28614875

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine (CID 177147679) is 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine is Cc1cc(C)c2c(N)nc(NCc3c(C)nn(C)c3C)nc2n1.
What is the InChIKey of 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is IHJGIGUPYWKATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N7/c1-8-6-9(2)19-15-13(8)14(17)20-16(21-15)18-7-12-10(3)22-23(5)11(12)4/h6H,7H2,1-5H3,(H3,17,18,19,20,21).
What are the key properties of 5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine?
5,7-dimethyl-2-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 311.39 g/mol, XLogP of 2.19, 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-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrido[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 177147679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).