N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine

C9H14FN3O — CID 143431201

IUPACN-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine
SMILESCCN(CCOC)c1ncncc1F
InChIInChI=1S/C9H14FN3O/c1-3-13(4-5-14-2)9-8(10)6-11-7-12-9/h6-7H,3-5H2,1-2H3
InChIKeyQCPPJCWUCDNVKH-UHFFFAOYSA-N
MW199.23 g/mol
LogP1.09
Rot. Bonds5

About N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine

N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine (PubChem CID 143431201) has the molecular formula C9H14FN3O and a molecular weight of 199.23 g/mol. Its IUPAC name is N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine
PubChem CID143431201
Molecular FormulaC9H14FN3O
Molecular Weight199.23 g/mol
Exact Mass199.11
IUPAC NameN-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine
SMILESCCN(CCOC)c1ncncc1F
InChIInChI=1S/C9H14FN3O/c1-3-13(4-5-14-2)9-8(10)6-11-7-12-9/h6-7H,3-5H2,1-2H3
InChIKeyQCPPJCWUCDNVKH-UHFFFAOYSA-N
XLogP1.09
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.23
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-ethyl-5-fluoro-4-N-(2-methoxyethyl)pyrimidine-2,4-diamine
CID 80809527
[4-[bis(2-methoxyethyl)amino]pyrimidin-5-yl]methanol
CID 114215034
4-N,6-N,5-triethyl-4-N-(2-methoxyethyl)pyrimidine-4,6-diamine
CID 80808569
6-N-ethyl-3,5-difluoro-6-N-(2-methoxyethyl)-2-N-methylpyridine-2,6-diamine
CID 114074249
N'-(5-bromopyrimidin-4-yl)-N'-(2-methoxyethyl)propane-1,3-diamine
CID 66341638
N,N-bis(2-methoxyethyl)-5-(methylaminomethyl)pyrimidin-4-amine
CID 114216195
4-(chloromethyl)-N-ethyl-3-fluoro-N-(2-methoxyethyl)pyridin-2-amine
CID 105383537
5-bromo-2-N-ethyl-2-N-(2-methoxyethyl)pyridine-2,3-diamine
CID 61444777
4-N-ethyl-4-N-propylpyrimidine-4,5-diamine
CID 79915949
N-ethyl-5-iodo-N-propylpyrimidin-4-amine
CID 66340600
4-(bromomethyl)-N-ethyl-2,6-difluoro-N-(2-methoxyethyl)aniline
CID 107081493
2-[(5-chloro-3-fluoro-2-pyridinyl)-(2-methoxyethyl)amino]ethanol
CID 115681797

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine (CID 143431201) is N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine is CCN(CCOC)c1ncncc1F.
What is the InChIKey of N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine?
The InChIKey is QCPPJCWUCDNVKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3O/c1-3-13(4-5-14-2)9-8(10)6-11-7-12-9/h6-7H,3-5H2,1-2H3.
What are the key properties of N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine?
N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine has a molecular weight of 199.23 g/mol, XLogP of 1.09, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-fluoro-N-(2-methoxyethyl)pyrimidin-4-amine is sourced from PubChem (CID 143431201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).