2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol

C10H18N4O — CID 80796436

IUPAC2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1cc(N)nc(C)n1
InChIInChI=1S/C10H18N4O/c1-3-4-14(5-6-15)10-7-9(11)12-8(2)13-10/h7,15H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyKORXVQVYNGQVOI-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.58
Rot. Bonds5

About 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol

2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol (PubChem CID 80796436) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol
PubChem CID80796436
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol
SMILESCCCN(CCO)c1cc(N)nc(C)n1
InChIInChI=1S/C10H18N4O/c1-3-4-14(5-6-15)10-7-9(11)12-8(2)13-10/h7,15H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyKORXVQVYNGQVOI-UHFFFAOYSA-N
XLogP0.58
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-ethyl-2-methyl-4-N-propylpyrimidine-4,6-diamine
CID 80775488
2-[(6-amino-2-methylpyrimidin-4-yl)-(2,2,2-trifluoroethyl)amino]ethanol
CID 107495365
2-[(6-amino-2-propylpyrimidin-4-yl)-(2-hydroxyethyl)amino]ethanol
CID 80955354
2-[(6-amino-2-phenylpyrimidin-4-yl)-propylamino]ethanol
CID 115915430
4-N,4-N-bis(2-methoxyethyl)-2-methylpyrimidine-4,6-diamine
CID 80794923
2-[(6-chloro-2-methylpyrimidin-4-yl)-ethylamino]ethanol
CID 62481923
4-N-butyl-4-N,2-dimethylpyrimidine-4,6-diamine
CID 80753579
2-[2-hydroxyethyl(propyl)amino]-6-methylpyridine-4-carbothioamide
CID 114767331
2-[ethyl-[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80791441
4-N-ethyl-2-methylsulfanyl-4-N-propylpyrimidine-4,6-diamine
CID 80774863
6-(dipropylamino)-2-methyl-N-pentylpyrimidine-4-carboxamide
CID 112846812
2-[[6-amino-4-(trifluoromethyl)-2-pyridinyl]-(2-methoxyethyl)amino]ethanol
CID 102719240

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol?
The IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol (CID 80796436) is 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol.
What is the SMILES notation for 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol?
The canonical SMILES for 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol is CCCN(CCO)c1cc(N)nc(C)n1.
What is the InChIKey of 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol?
The InChIKey is KORXVQVYNGQVOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-3-4-14(5-6-15)10-7-9(11)12-8(2)13-10/h7,15H,3-6H2,1-2H3,(H2,11,12,13).
What are the key properties of 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol?
2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol has a molecular weight of 210.28 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-methylpyrimidin-4-yl)-propylamino]ethanol is sourced from PubChem (CID 80796436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).