4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine

C12H19N3 — CID 103736984

IUPAC4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCC2(C)CCC2)n1
InChIInChI=1S/C12H19N3/c1-9-7-10(2)15-11(14-9)13-8-12(3)5-4-6-12/h7H,4-6,8H2,1-3H3,(H,13,14,15)
InChIKeyBAGFCDZRWFWJND-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.70
Rot. Bonds3

About 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine

4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine (PubChem CID 103736984) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
PubChem CID103736984
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
SMILESCc1cc(C)nc(NCC2(C)CCC2)n1
InChIInChI=1S/C12H19N3/c1-9-7-10(2)15-11(14-9)13-8-12(3)5-4-6-12/h7H,4-6,8H2,1-3H3,(H,13,14,15)
InChIKeyBAGFCDZRWFWJND-UHFFFAOYSA-N
XLogP2.70
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,6-dimethyl-N-[(4-methyloxan-4-yl)methyl]pyrimidin-2-amine
CID 103743092
N-[(1,4-dimethylpiperidin-4-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 103989884
4,6-dimethoxy-N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 115355130
N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine
CID 103736890
3-[[(4,6-dimethylpyrimidin-2-yl)amino]methyl]-3,5,5-trimethylcyclohexan-1-ol
CID 53344921
1,5-dimethyl-N-[(1-methylcyclobutyl)methyl]-1,2,4-triazol-3-amine
CID 131031497
N-[(1-methylcyclopentyl)methyl]pyrimidin-2-amine
CID 63822155
2-[(1-aminocyclobutyl)methylamino]-6-methylpyrimidine-4-carbonitrile
CID 107552758
1-[[(4,6-dimethylpyrimidin-2-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 65118322
1-[[(4,6-dimethylpyrimidin-2-yl)amino]methyl]-3-methylcyclohexan-1-ol
CID 63962757
6-methyl-N-[(1-methylcyclopentyl)methyl]pyrimidin-4-amine
CID 63830485
6-methyl-2-[(1-methylsulfanylcyclopentyl)methylamino]pyrimidine-4-carbonitrile
CID 114116293

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine?
The IUPAC name of 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine (CID 103736984) is 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine?
The canonical SMILES for 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine is Cc1cc(C)nc(NCC2(C)CCC2)n1.
What is the InChIKey of 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine?
The InChIKey is BAGFCDZRWFWJND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-7-10(2)15-11(14-9)13-8-12(3)5-4-6-12/h7H,4-6,8H2,1-3H3,(H,13,14,15).
What are the key properties of 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine?
4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine has a molecular weight of 205.30 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-[(1-methylcyclobutyl)methyl]pyrimidin-2-amine is sourced from PubChem (CID 103736984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).