[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol

C11H19N3O3 — CID 114215034

IUPAC[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol
SMILESCOCCN(CCOC)c1ncncc1CO
InChIInChI=1S/C11H19N3O3/c1-16-5-3-14(4-6-17-2)11-10(8-15)7-12-9-13-11/h7,9,15H,3-6,8H2,1-2H3
InChIKeyBCCKADYCNMPOPU-UHFFFAOYSA-N
MW241.29 g/mol
LogP0.07
Rot. Bonds8

About [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol

[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol (PubChem CID 114215034) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol
PubChem CID114215034
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol
SMILESCOCCN(CCOC)c1ncncc1CO
InChIInChI=1S/C11H19N3O3/c1-16-5-3-14(4-6-17-2)11-10(8-15)7-12-9-13-11/h7,9,15H,3-6,8H2,1-2H3
InChIKeyBCCKADYCNMPOPU-UHFFFAOYSA-N
XLogP0.07
TPSA67.71 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-bis(2-methoxyethyl)-5-(methylaminomethyl)pyrimidin-4-amine
CID 114216195
N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine
CID 143431201
N'-(5-bromopyrimidin-4-yl)-N'-(2-methoxyethyl)propane-1,3-diamine
CID 66341638
[4-[bis(2-methoxyethyl)amino]-6-methyl-3-pyridinyl]methanol
CID 81239387
N,N-bis(2-methoxyethyl)quinazolin-4-amine
CID 21104388
[4-[cyclobutyl(methyl)amino]pyrimidin-5-yl]methanol
CID 126974271
3-[(5-iodopyrimidin-4-yl)-(2-methoxyethyl)amino]propanimidamide
CID 66340748
2-[6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl(2-methoxyethyl)amino]ethanol
CID 115672547
2-[(5-amino-6-ethoxypyrimidin-4-yl)-(2-methoxyethyl)amino]ethanol
CID 113467648
4-N,4-N-bis(2-methoxyethyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80795868
2-[(5-chloro-3-fluoro-2-pyridinyl)-(2-methoxyethyl)amino]ethanol
CID 115681797
[2-[bis(2-ethoxyethyl)amino]-3-pyridinyl]methanol
CID 82960882

Frequently Asked Questions

What is the IUPAC name of [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol?
The IUPAC name of [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol (CID 114215034) is [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol.
What is the SMILES notation for [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol?
The canonical SMILES for [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol is COCCN(CCOC)c1ncncc1CO.
What is the InChIKey of [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol?
The InChIKey is BCCKADYCNMPOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-16-5-3-14(4-6-17-2)11-10(8-15)7-12-9-13-11/h7,9,15H,3-6,8H2,1-2H3.
What are the key properties of [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol?
[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol has a molecular weight of 241.29 g/mol, XLogP of 0.07, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol is sourced from PubChem (CID 114215034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).