1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol

C10H19N5O — CID 106141561

IUPAC1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCN(C)CC(C)(O)CNc1ncc(N)cn1
InChIInChI=1S/C10H19N5O/c1-10(16,7-15(2)3)6-14-9-12-4-8(11)5-13-9/h4-5,16H,6-7,11H2,1-3H3,(H,12,13,14)
InChIKeyVLVAGMVLVIIFIC-UHFFFAOYSA-N
MW225.30 g/mol
LogP-0.22
Rot. Bonds5

About 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol

1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol (PubChem CID 106141561) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
PubChem CID106141561
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
SMILESCN(C)CC(C)(O)CNc1ncc(N)cn1
InChIInChI=1S/C10H19N5O/c1-10(16,7-15(2)3)6-14-9-12-4-8(11)5-13-9/h4-5,16H,6-7,11H2,1-3H3,(H,12,13,14)
InChIKeyVLVAGMVLVIIFIC-UHFFFAOYSA-N
XLogP-0.22
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(5-aminopyrimidin-2-yl)amino]-2,4-dimethylpentan-2-ol
CID 66180510
1-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106149395
1-[[5-bromo-2-(methylamino)pyrimidin-4-yl]amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106150117
1-[[5-amino-2-(trifluoromethyl)-4-pyridinyl]amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106141985
1-[(6-amino-5-propylpyrimidin-4-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106150169
1-[(5-amino-6-methoxypyrimidin-4-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106141779
1-[(3-amino-6-methyl-2-pyridinyl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106141588
3-[(5-aminopyrimidin-2-yl)amino]-2-methylbutan-2-ol
CID 130865428
1-(dimethylamino)-3-[[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropan-2-ol
CID 106150231
1-[(3-amino-1,2,4-thiadiazol-5-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106149684
1-[(8-aminoisoquinolin-5-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol
CID 106141945
3-amino-2-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]pyridine-4-carbonitrile
CID 106141918

Frequently Asked Questions

What is the IUPAC name of 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol (CID 106141561) is 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol is CN(C)CC(C)(O)CNc1ncc(N)cn1.
What is the InChIKey of 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol?
The InChIKey is VLVAGMVLVIIFIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-10(16,7-15(2)3)6-14-9-12-4-8(11)5-13-9/h4-5,16H,6-7,11H2,1-3H3,(H,12,13,14).
What are the key properties of 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol?
1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol has a molecular weight of 225.30 g/mol, XLogP of -0.22, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-aminopyrimidin-2-yl)amino]-3-(dimethylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 106141561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).