6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine

C13H22N4O — CID 94076559

IUPAC6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
SMILESCOCc1cc(NCC2CCNCC2)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-10-16-12(9-18-2)7-13(17-10)15-8-11-3-5-14-6-4-11/h7,11,14H,3-6,8-9H2,1-2H3,(H,15,16,17)
InChIKeyDCTDQCGGMUSJCV-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.34
Rot. Bonds5

About 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine

6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine (PubChem CID 94076559) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
PubChem CID94076559
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
SMILESCOCc1cc(NCC2CCNCC2)nc(C)n1
InChIInChI=1S/C13H22N4O/c1-10-16-12(9-18-2)7-13(17-10)15-8-11-3-5-14-6-4-11/h7,11,14H,3-6,8-9H2,1-2H3,(H,15,16,17)
InChIKeyDCTDQCGGMUSJCV-UHFFFAOYSA-N
XLogP1.34
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-2-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563627
2-methyl-N-(piperidin-4-ylmethyl)-6-propan-2-ylpyrimidin-4-amine
CID 94076556
2,6-dimethyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-4-amine
CID 80563958
2-chloro-6-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 71638564
N-(cyclopropylmethyl)-2,6-dimethylpyrimidin-4-amine
CID 60732015
2-chloro-6-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine;hydrochloride
CID 71638563
4-[[(6-ethyl-2-methylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 106130133
2-(4-fluorophenyl)-6-(methoxymethyl)-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 56768398
2-cyclopropyl-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62320790
2-(3,4-dihydro-1H-isoquinolin-2-yl)-6-(methoxymethyl)-N-(piperidin-3-ylmethyl)pyrimidin-4-amine
CID 71564248
N-(cyclopropylmethyl)-2-methyl-6-(trifluoromethyl)pyrimidin-4-amine
CID 171993956
2-[[6-(cyclohexylmethylamino)-2-methylpyrimidin-4-yl]amino]acetonitrile
CID 115266821

Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine (CID 94076559) is 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine is COCc1cc(NCC2CCNCC2)nc(C)n1.
What is the InChIKey of 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine?
The InChIKey is DCTDQCGGMUSJCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-10-16-12(9-18-2)7-13(17-10)15-8-11-3-5-14-6-4-11/h7,11,14H,3-6,8-9H2,1-2H3,(H,15,16,17).
What are the key properties of 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine?
6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 94076559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).