1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol

C14H26N4O2 — CID 80983293

IUPAC1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol
SMILESCCCc1nc(NC)c(C)c(N(C)CC(O)COC)n1
InChIInChI=1S/C14H26N4O2/c1-6-7-12-16-13(15-3)10(2)14(17-12)18(4)8-11(19)9-20-5/h11,19H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyGPWIFYOOZRFMLQ-UHFFFAOYSA-N
MW282.39 g/mol
LogP1.22
Rot. Bonds8

About 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol

1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol (PubChem CID 80983293) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol.

Molecular Properties

Compound Name1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol
PubChem CID80983293
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol
SMILESCCCc1nc(NC)c(C)c(N(C)CC(O)COC)n1
InChIInChI=1S/C14H26N4O2/c1-6-7-12-16-13(15-3)10(2)14(17-12)18(4)8-11(19)9-20-5/h11,19H,6-9H2,1-5H3,(H,15,16,17)
InChIKeyGPWIFYOOZRFMLQ-UHFFFAOYSA-N
XLogP1.22
TPSA70.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-2-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80987499
N-methyl-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propanamide
CID 106918503
1-[(2-tert-butyl-6-hydrazinyl-5-methylpyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 80995833
4-N-(3-methoxy-2-methylpropyl)-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80982288
4-N-(cyclohexylmethyl)-4-N,6-N,5-trimethyl-2-propylpyrimidine-4,6-diamine
CID 80987928
1-[(6-chloro-2,5-dimethylpyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 63729834
2-ethyl-4-N,6-N,5-trimethyl-4-N-(2-methylbutyl)pyrimidine-4,6-diamine
CID 80993377
1-[[6-(ethylamino)-2-propylpyrimidin-4-yl]-methylamino]-3-methoxypropan-2-ol
CID 80954748
6-N-ethyl-4-N,5-dimethyl-4-N-(3-methylbutyl)-2-propylpyrimidine-4,6-diamine
CID 80986177
4-N,5-dimethyl-4-N-(3-methylbutyl)-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80987790
4-N-[2-(dimethylamino)propyl]-6-N,5-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80982651
1-[methyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-2-ol
CID 80982737

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol?
The IUPAC name of 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol (CID 80983293) is 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol.
What is the SMILES notation for 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol?
The canonical SMILES for 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol is CCCc1nc(NC)c(C)c(N(C)CC(O)COC)n1.
What is the InChIKey of 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol?
The InChIKey is GPWIFYOOZRFMLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-6-7-12-16-13(15-3)10(2)14(17-12)18(4)8-11(19)9-20-5/h11,19H,6-9H2,1-5H3,(H,15,16,17).
What are the key properties of 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol?
1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol has a molecular weight of 282.39 g/mol, XLogP of 1.22, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-[methyl-[5-methyl-6-(methylamino)-2-propylpyrimidin-4-yl]amino]propan-2-ol is sourced from PubChem (CID 80983293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).