2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol

C10H18N4O — CID 107542229

IUPAC2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol
SMILESCc1cc(CN)nc(N(C)C(C)CO)n1
InChIInChI=1S/C10H18N4O/c1-7-4-9(5-11)13-10(12-7)14(3)8(2)6-15/h4,8,15H,5-6,11H2,1-3H3
InChIKeyUVPISYRTAKNBSU-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.06
Rot. Bonds4

About 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol

2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol (PubChem CID 107542229) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol.

Molecular Properties

Compound Name2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol
PubChem CID107542229
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol
SMILESCc1cc(CN)nc(N(C)C(C)CO)n1
InChIInChI=1S/C10H18N4O/c1-7-4-9(5-11)13-10(12-7)14(3)8(2)6-15/h4,8,15H,5-6,11H2,1-3H3
InChIKeyUVPISYRTAKNBSU-UHFFFAOYSA-N
XLogP0.06
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[6-methyl-2-[methyl(propan-2-yl)amino]pyrimidin-4-yl]methanol
CID 130485751
2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-propan-2-ylamino]ethanol
CID 107541812
2-[methyl-(4-methylpyrimidin-2-yl)amino]propan-1-ol
CID 115765259
N-(1-chloropropan-2-yl)-N,4,6-trimethylpyrimidin-2-amine
CID 104555420
2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]-N,N-diethylacetamide
CID 107541774
2-[methyl-(6-methyl-2-propan-2-ylpyrimidin-4-yl)amino]propan-1-ol
CID 115868780
2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-propylamino]-N,N-dimethylacetamide
CID 107541801
2-[1-hydroxypropan-2-yl(methyl)amino]-4,6-dimethylpyridine-3-carbothioamide
CID 113426031
N'-hydroxy-2-[1-hydroxypropan-2-yl(methyl)amino]-6-methylpyridine-4-carboximidamide
CID 137013645
2-[(5-aminopyrimidin-2-yl)-methylamino]propan-1-ol
CID 104551057
2-[(6-amino-2-methylquinolin-4-yl)-methylamino]propan-1-ol
CID 113425931
4-(aminomethyl)-N-cyclopentyl-6-methyl-N-(2-methylpropyl)pyrimidin-2-amine
CID 107542143

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol?
The IUPAC name of 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol (CID 107542229) is 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol.
What is the SMILES notation for 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol?
The canonical SMILES for 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol is Cc1cc(CN)nc(N(C)C(C)CO)n1.
What is the InChIKey of 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol?
The InChIKey is UVPISYRTAKNBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-7-4-9(5-11)13-10(12-7)14(3)8(2)6-15/h4,8,15H,5-6,11H2,1-3H3.
What are the key properties of 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol?
2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol has a molecular weight of 210.28 g/mol, XLogP of 0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(aminomethyl)-6-methylpyrimidin-2-yl]-methylamino]propan-1-ol is sourced from PubChem (CID 107542229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).