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

C14H26N4O — CID 106358084

IUPAC4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCCCc1c(NC)ncnc1NC(CCO)C(C)C
InChIInChI=1S/C14H26N4O/c1-5-6-11-13(15-4)16-9-17-14(11)18-12(7-8-19)10(2)3/h9-10,12,19H,5-8H2,1-4H3,(H2,15,16,17,18)
InChIKeyHORGOUMKDFSDIL-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.29
Rot. Bonds8

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

4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol (PubChem CID 106358084) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol.

Molecular Properties

Compound Name4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
PubChem CID106358084
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCCCc1c(NC)ncnc1NC(CCO)C(C)C
InChIInChI=1S/C14H26N4O/c1-5-6-11-13(15-4)16-9-17-14(11)18-12(7-8-19)10(2)3/h9-10,12,19H,5-8H2,1-4H3,(H2,15,16,17,18)
InChIKeyHORGOUMKDFSDIL-UHFFFAOYSA-N
XLogP2.29
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
CID 80852754
4-methoxy-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]butan-1-ol
CID 106163035
(2S)-3-methyl-2-[[5-propyl-6-(propylamino)pyrimidin-4-yl]amino]butan-1-ol
CID 80848746
6-N-methyl-4-N-(5-methylhexan-2-yl)-5-propylpyrimidine-4,6-diamine
CID 80839230
6-N-methyl-4-N-(1-methylsulfanylpropan-2-yl)-5-propylpyrimidine-4,6-diamine
CID 113473144
2-methyl-5-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
CID 106163228
6-N-methyl-4-N-(3-methyl-2-propan-2-ylbutyl)-5-propylpyrimidine-4,6-diamine
CID 102908880
6-N-methyl-4-N-(4-methylpentyl)-5-propylpyrimidine-4,6-diamine
CID 80831818
4-N-ethyl-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80770650
4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
CID 80852827
3-[(5-amino-6-propoxypyrimidin-4-yl)amino]-4-methylpentan-1-ol
CID 106348239
6-N-methyl-5-propyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80825050

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The IUPAC name of 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol (CID 106358084) is 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol.
What is the SMILES notation for 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The canonical SMILES for 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol is CCCc1c(NC)ncnc1NC(CCO)C(C)C.
What is the InChIKey of 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The InChIKey is HORGOUMKDFSDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-5-6-11-13(15-4)16-9-17-14(11)18-12(7-8-19)10(2)3/h9-10,12,19H,5-8H2,1-4H3,(H2,15,16,17,18).
What are the key properties of 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol has a molecular weight of 266.39 g/mol, XLogP of 2.29, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol is sourced from PubChem (CID 106358084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).