2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid

C10H13N3O2 — CID 107553609

IUPAC2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(N(C)C2CC2)n1
InChIInChI=1S/C10H13N3O2/c1-6-5-8(9(14)15)12-10(11-6)13(2)7-3-4-7/h5,7H,3-4H2,1-2H3,(H,14,15)
InChIKeyMAEYSMNBNFDSLD-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.08
Rot. Bonds3

About 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid

2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid (PubChem CID 107553609) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid
PubChem CID107553609
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid
SMILESCc1cc(C(=O)O)nc(N(C)C2CC2)n1
InChIInChI=1S/C10H13N3O2/c1-6-5-8(9(14)15)12-10(11-6)13(2)7-3-4-7/h5,7H,3-4H2,1-2H3,(H,14,15)
InChIKeyMAEYSMNBNFDSLD-UHFFFAOYSA-N
XLogP1.08
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-2-[methyl-(4-methylcyclohexyl)amino]pyrimidine-4-carboxylic acid
CID 107553809
2-[1-cyclopropylethyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid
CID 107553650
2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboximidamide
CID 107550128
6-methyl-2-[methyl(pentan-3-yl)amino]pyrimidine-4-carboxylic acid
CID 107553644
2-[(4-ethylcyclohexyl)-methylamino]-6-methylpyrimidine-4-carbothioamide
CID 107546845
6-methyl-2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pyrimidine-4-carboxylic acid
CID 107553927
6-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidine-4-carboximidamide
CID 107550091
2-[cyclopropyl(methyl)amino]-4-methylpyrimidine-5-carboxylic acid
CID 83181070
2,6-dimethyl-4-[methyl-(4-methylcyclohexyl)amino]pyridine-3-carboxylic acid
CID 81053226
4,6-dimethyl-2-[methyl-(4-methylcyclohexyl)amino]pyridine-3-carboxylic acid
CID 60677924
2-[(1,1-dioxothiolan-3-yl)-methylamino]-6-methylpyrimidine-4-carbothioamide
CID 107546694
2-[(1,1-dioxothiolan-3-yl)-methylamino]-6-methyl-N,N-dipropylpyrimidine-4-carboxamide
CID 109331431

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid?
The IUPAC name of 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid (CID 107553609) is 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid.
What is the SMILES notation for 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid?
The canonical SMILES for 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid is Cc1cc(C(=O)O)nc(N(C)C2CC2)n1.
What is the InChIKey of 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid?
The InChIKey is MAEYSMNBNFDSLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-6-5-8(9(14)15)12-10(11-6)13(2)7-3-4-7/h5,7H,3-4H2,1-2H3,(H,14,15).
What are the key properties of 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid?
2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid has a molecular weight of 207.23 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(methyl)amino]-6-methylpyrimidine-4-carboxylic acid is sourced from PubChem (CID 107553609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).