2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine

C10H14N6 — CID 146843134

IUPAC2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
SMILESCc1nc(C)c(N)c(NCc2cn[nH]c2)n1
InChIInChI=1S/C10H14N6/c1-6-9(11)10(16-7(2)15-6)12-3-8-4-13-14-5-8/h4-5H,3,11H2,1-2H3,(H,13,14)(H,12,15,16)
InChIKeySGNOKCUZWVUHNP-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.01
Rot. Bonds3

About 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine

2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine (PubChem CID 146843134) has the molecular formula C10H14N6 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine.

Molecular Properties

Compound Name2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
PubChem CID146843134
Molecular FormulaC10H14N6
Molecular Weight218.26 g/mol
Exact Mass218.13
IUPAC Name2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
SMILESCc1nc(C)c(N)c(NCc2cn[nH]c2)n1
InChIInChI=1S/C10H14N6/c1-6-9(11)10(16-7(2)15-6)12-3-8-4-13-14-5-8/h4-5H,3,11H2,1-2H3,(H,13,14)(H,12,15,16)
InChIKeySGNOKCUZWVUHNP-UHFFFAOYSA-N
XLogP1.01
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 5-[[(5-amino-2,6-dimethylpyrimidin-4-yl)amino]methyl]pyridine-2-carboxylate
CID 158779478
4-chloro-2-methyl-6-(1H-pyrazol-4-ylmethylamino)pyrimidine-5-carbaldehyde
CID 106193412
3-N-(1H-pyrazol-4-ylmethyl)pyrazine-2,3-diamine
CID 102983865
4-N-[(3-bromophenyl)methyl]-2,6-dimethylpyrimidine-4,5-diamine
CID 158200511
4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine
CID 79918333
3-methyl-1-propyl-5-N-(1H-pyrazol-4-ylmethyl)pyrazole-4,5-diamine
CID 66027834
2-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-4-amine
CID 62784731
2-tert-butyl-6-chloro-5-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-4-amine
CID 114156509
N-methyl-1-(1H-pyrazol-4-yl)methanamine
CID 22929644
4-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-2-amine
CID 62958563
4-N-[(4-chlorophenyl)methyl]-6-methoxy-2-methylpyrimidine-4,5-diamine
CID 82455360
6-ethoxy-5-methyl-N-(1H-pyrazol-4-ylmethyl)pyrimidin-4-amine
CID 66327056

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine?
The IUPAC name of 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine (CID 146843134) is 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine.
What is the SMILES notation for 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine?
The canonical SMILES for 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine is Cc1nc(C)c(N)c(NCc2cn[nH]c2)n1.
What is the InChIKey of 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine?
The InChIKey is SGNOKCUZWVUHNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6/c1-6-9(11)10(16-7(2)15-6)12-3-8-4-13-14-5-8/h4-5H,3,11H2,1-2H3,(H,13,14)(H,12,15,16).
What are the key properties of 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine?
2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine has a molecular weight of 218.26 g/mol, XLogP of 1.01, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-N-(1H-pyrazol-4-ylmethyl)pyrimidine-4,5-diamine is sourced from PubChem (CID 146843134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).