6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid

C10H13N3O2 — CID 107553377

IUPAC6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(NC2CC2C)n1
InChIInChI=1S/C10H13N3O2/c1-5-3-7(5)12-10-11-6(2)4-8(13-10)9(14)15/h4-5,7H,3H2,1-2H3,(H,14,15)(H,11,12,13)
InChIKeySKWKOAVZQIHXMW-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.30
Rot. Bonds3

About 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid

6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid (PubChem CID 107553377) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid
PubChem CID107553377
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(NC2CC2C)n1
InChIInChI=1S/C10H13N3O2/c1-5-3-7(5)12-10-11-6(2)4-8(13-10)9(14)15/h4-5,7H,3H2,1-2H3,(H,14,15)(H,11,12,13)
InChIKeySKWKOAVZQIHXMW-UHFFFAOYSA-N
XLogP1.30
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-hydroxycyclobutyl)amino]-6-methylpyrimidine-4-carboxylic acid
CID 107554123
2-(cyclopropanecarbonylamino)-6-methylpyrimidine-4-carboxylic acid
CID 67508732
6-methyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pyrimidine-4-carboxylic acid
CID 107553354
2-(2,2-dicyclopropylethylamino)-6-methylpyrimidine-4-carboxylic acid
CID 107554108
6-[(2-methylcyclopropyl)amino]pyridine-2-carboxylic acid
CID 62409955
4-methyl-N-(2-methylcyclopropyl)-6-propoxypyrimidin-2-amine
CID 112637482
6-methyl-2-[(5-methylpyrazin-2-yl)methylamino]pyrimidine-4-carboxylic acid
CID 107553849
6-methyl-2-(2-methylprop-2-enylamino)pyrimidine-4-carboxylic acid
CID 107554495
6-methyl-2-(3-methylbut-2-enylamino)pyrimidine-4-carboxylic acid
CID 106197907
2-(3,5-dichloroanilino)-6-methylpyrimidine-4-carboxylic acid
CID 71689168
4,6-dimethyl-N-(2-methylcyclopentyl)pyrimidin-2-amine
CID 63281309
2-(4-hydroxybutan-2-ylamino)-6-methylpyrimidine-4-carboxylic acid
CID 107554311

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid?
The IUPAC name of 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid (CID 107553377) is 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid.
What is the SMILES notation for 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid?
The canonical SMILES for 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid is Cc1cc(C(=O)O)nc(NC2CC2C)n1.
What is the InChIKey of 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid?
The InChIKey is SKWKOAVZQIHXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-5-3-7(5)12-10-11-6(2)4-8(13-10)9(14)15/h4-5,7H,3H2,1-2H3,(H,14,15)(H,11,12,13).
What are the key properties of 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid?
6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid has a molecular weight of 207.23 g/mol, XLogP of 1.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(2-methylcyclopropyl)amino]pyrimidine-4-carboxylic acid is sourced from PubChem (CID 107553377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).