2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide

C11H18N6O — CID 114220417

IUPAC2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NN2CCN(C)CC2)nc(N)n1
InChIInChI=1S/C11H18N6O/c1-8-7-9(14-11(12)13-8)10(18)15-17-5-3-16(2)4-6-17/h7H,3-6H2,1-2H3,(H,15,18)(H2,12,13,14)
InChIKeyRDMRIMYEPGVRJA-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.74
Rot. Bonds2

About 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide

2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide (PubChem CID 114220417) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide
PubChem CID114220417
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide
SMILESCc1cc(C(=O)NN2CCN(C)CC2)nc(N)n1
InChIInChI=1S/C11H18N6O/c1-8-7-9(14-11(12)13-8)10(18)15-17-5-3-16(2)4-6-17/h7H,3-6H2,1-2H3,(H,15,18)(H2,12,13,14)
InChIKeyRDMRIMYEPGVRJA-UHFFFAOYSA-N
XLogP-0.74
TPSA87.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 83024475
methyl 2-amino-6-methylpyrimidine-4-carboxylate
CID 818455
N-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 4065138
2-amino-6-methyl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]pyrimidine-4-carboxamide
CID 91771967
4-chloro-N-(4-methylpiperazin-1-yl)quinoline-2-carboxamide
CID 83017398
2-amino-6-methyl-N-pyrimidin-5-ylpyrimidine-4-carboxamide
CID 114220494
2-(4,6-dimethylpyrimidin-2-yl)-1-(4-methylpiperazin-1-yl)guanidine
CID 606306
2-amino-N-(3-methoxycyclobutyl)-6-methylpyrimidine-4-carboxamide
CID 114220508
3-amino-2-methyl-N-(4-methylpiperazin-1-yl)benzamide
CID 83013438
2-amino-6-methyl-N-(3-methylbutyl)pyrimidine-4-carboxamide
CID 82171955
2-amino-6-methyl-N-[(3R,4R)-4-pyrrolidin-1-yloxolan-3-yl]pyrimidine-4-carboxamide
CID 118778494
6-(ethylamino)-N-(4-methylpiperazin-1-yl)pyridine-2-carboxamide
CID 83024382

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide?
The IUPAC name of 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide (CID 114220417) is 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide.
What is the SMILES notation for 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide?
The canonical SMILES for 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide is Cc1cc(C(=O)NN2CCN(C)CC2)nc(N)n1.
What is the InChIKey of 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide?
The InChIKey is RDMRIMYEPGVRJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-8-7-9(14-11(12)13-8)10(18)15-17-5-3-16(2)4-6-17/h7H,3-6H2,1-2H3,(H,15,18)(H2,12,13,14).
What are the key properties of 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide?
2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-(4-methylpiperazin-1-yl)pyrimidine-4-carboxamide is sourced from PubChem (CID 114220417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).