4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol

C14H26N4O — CID 80852827

IUPAC4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCCCc1c(NCC)ncnc1NC(C)CCCO
InChIInChI=1S/C14H26N4O/c1-4-7-12-13(15-5-2)16-10-17-14(12)18-11(3)8-6-9-19/h10-11,19H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyZGYSNXVPSCSWQA-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.43
Rot. Bonds9

About 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol

4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol (PubChem CID 80852827) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol.

Molecular Properties

Compound Name4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
PubChem CID80852827
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCCCc1c(NCC)ncnc1NC(C)CCCO
InChIInChI=1S/C14H26N4O/c1-4-7-12-13(15-5-2)16-10-17-14(12)18-11(3)8-6-9-19/h10-11,19H,4-9H2,1-3H3,(H2,15,16,17,18)
InChIKeyZGYSNXVPSCSWQA-UHFFFAOYSA-N
XLogP2.43
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol with MolForge

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Related Compounds

4-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
CID 80852754
6-N-ethyl-4-N-hexan-2-yl-5-propylpyrimidine-4,6-diamine
CID 80822476
N-hexan-2-yl-6-hydrazinyl-5-propylpyrimidin-4-amine
CID 80907974
6-N-methyl-4-N-(5-methylhexan-2-yl)-5-propylpyrimidine-4,6-diamine
CID 80839230
4-[(6-ethyl-5-fluoropyrimidin-4-yl)amino]pentan-1-ol
CID 103880365
3-[2-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]ethylsulfanyl]propan-1-ol
CID 106311785
N-ethyl-2-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]propanamide
CID 80800852
4-methyl-3-[[6-(methylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol
CID 106358084
4-[(6-amino-5-propan-2-ylpyrimidin-4-yl)amino]pentan-1-ol
CID 80852599
3-N-(6-hydrazinyl-5-propylpyrimidin-4-yl)-1-N,1-N-dimethylbutane-1,3-diamine
CID 80904538
4-N-ethyl-6-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80770650
5-ethyl-4-N-hexan-2-yl-6-N-methylpyrimidine-4,6-diamine
CID 80822887

Frequently Asked Questions

What is the IUPAC name of 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The IUPAC name of 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol (CID 80852827) is 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol.
What is the SMILES notation for 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The canonical SMILES for 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol is CCCc1c(NCC)ncnc1NC(C)CCCO.
What is the InChIKey of 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
The InChIKey is ZGYSNXVPSCSWQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-7-12-13(15-5-2)16-10-17-14(12)18-11(3)8-6-9-19/h10-11,19H,4-9H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol?
4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol has a molecular weight of 266.39 g/mol, XLogP of 2.43, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]pentan-1-ol is sourced from PubChem (CID 80852827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).