[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol

C11H18N4O — CID 80757639

IUPAC[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol
SMILESCc1cnc(N)nc1N1CCC(CO)CC1
InChIInChI=1S/C11H18N4O/c1-8-6-13-11(12)14-10(8)15-4-2-9(7-16)3-5-15/h6,9,16H,2-5,7H2,1H3,(H2,12,13,14)
InChIKeyHQSJAZBTELVOGC-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.58
Rot. Bonds2

About [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol

[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol (PubChem CID 80757639) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol
PubChem CID80757639
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol
SMILESCc1cnc(N)nc1N1CCC(CO)CC1
InChIInChI=1S/C11H18N4O/c1-8-6-13-11(12)14-10(8)15-4-2-9(7-16)3-5-15/h6,9,16H,2-5,7H2,1H3,(H2,12,13,14)
InChIKeyHQSJAZBTELVOGC-UHFFFAOYSA-N
XLogP0.58
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]acetamide
CID 80806378
[1-(2-amino-5-bromopyrimidin-4-yl)piperidin-4-yl]methanol
CID 80756578
4-[3-(methoxymethyl)pyrrolidin-1-yl]-5-methylpyrimidin-2-amine
CID 80844727
4-[4-(cyclopropylmethyl)piperazin-1-yl]-5-methylpyrimidin-2-amine
CID 80800020
5-methyl-4-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-2-amine
CID 80798047
[1-(3-amino-5-methyl-2-pyridinyl)piperidin-4-yl]methanol
CID 66277981
[1-(3-methyl-2-pyridinyl)piperidin-4-yl]methanol
CID 62254085
5-methyl-4-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)pyrimidin-2-amine
CID 81205894
4-(2-amino-5-methylpyrimidin-4-yl)-1-methylpiperazin-2-one
CID 80844331
[1-(3-bromo-4-methyl-2-pyridinyl)piperidin-4-yl]methanol
CID 106876332
[1-(6-amino-5-methyl-2-propylpyrimidin-4-yl)piperidin-4-yl]methanol
CID 80977068
4-(4-benzylpiperazin-1-yl)-5-methylpyrimidin-2-amine
CID 80756967

Frequently Asked Questions

What is the IUPAC name of [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol?
The IUPAC name of [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol (CID 80757639) is [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol.
What is the SMILES notation for [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol?
The canonical SMILES for [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol is Cc1cnc(N)nc1N1CCC(CO)CC1.
What is the InChIKey of [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol?
The InChIKey is HQSJAZBTELVOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-6-13-11(12)14-10(8)15-4-2-9(7-16)3-5-15/h6,9,16H,2-5,7H2,1H3,(H2,12,13,14).
What are the key properties of [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol?
[1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-amino-5-methylpyrimidin-4-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 80757639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).