4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline

C17H19N5O2 — CID 70676084

IUPAC4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline
SMILESCOCCOc1cnc2ncnc(-c3ccc(N(C)C)cc3)c2n1
InChIInChI=1S/C17H19N5O2/c1-22(2)13-6-4-12(5-7-13)15-16-17(20-11-19-15)18-10-14(21-16)24-9-8-23-3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyRPYFFUOHZUKCSW-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.18
Rot. Bonds6

About 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline

4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline (PubChem CID 70676084) has the molecular formula C17H19N5O2 and a molecular weight of 325.37 g/mol. Its IUPAC name is 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline
PubChem CID70676084
Molecular FormulaC17H19N5O2
Molecular Weight325.37 g/mol
Exact Mass325.15
IUPAC Name4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline
SMILESCOCCOc1cnc2ncnc(-c3ccc(N(C)C)cc3)c2n1
InChIInChI=1S/C17H19N5O2/c1-22(2)13-6-4-12(5-7-13)15-16-17(20-11-19-15)18-10-14(21-16)24-9-8-23-3/h4-7,10-11H,8-9H2,1-3H3
InChIKeyRPYFFUOHZUKCSW-UHFFFAOYSA-N
XLogP2.18
TPSA73.26 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-fluorophenyl)-4-(2-methoxyethoxy)pteridine
CID 24794957
6-[4-(2-methoxyethoxy)phenyl]-7H-purine
CID 122559987
4-chloro-6-[4-(dimethylamino)phenyl]pyrimidin-5-amine
CID 87840159
4-[6-[4-(dimethylamino)phenyl]-3-ethoxy-1,2,4-triazin-5-yl]-N,N-dimethylaniline
CID 20549288
N-methoxy-2-(2-methoxyethoxy)-N-methylpyridine-4-carboxamide
CID 119100133
4-[5-(5-methoxypentyl)-1,3-oxazol-2-yl]-N,N-dimethylaniline
CID 154508032
4-[5-[4-(dimethylamino)phenyl]pyrazin-2-yl]-N,N-dimethylaniline
CID 102012408
3-[4-[5,6-bis[4-(2-methoxyethoxy)phenyl]-1,2,4-triazin-3-yl]phenyl]-5,6-bis[4-(2-methoxyethoxy)phenyl]-1,2,4-triazine;methane
CID 159687313
3-[4-(dimethylamino)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 123666078
7-bromo-2-(2-methoxyethoxy)quinoxaline
CID 66664870
[3-chloro-6-(2-methoxyethoxy)-2-pyridinyl]methanol
CID 61257163
6-benzyl-7-[4-(dimethylamino)phenyl]pyrido[2,3-d]pyrimidin-4-amine
CID 10291751

Frequently Asked Questions

What is the IUPAC name of 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline?
The IUPAC name of 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline (CID 70676084) is 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline?
The canonical SMILES for 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline is COCCOc1cnc2ncnc(-c3ccc(N(C)C)cc3)c2n1.
What is the InChIKey of 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline?
The InChIKey is RPYFFUOHZUKCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2/c1-22(2)13-6-4-12(5-7-13)15-16-17(20-11-19-15)18-10-14(21-16)24-9-8-23-3/h4-7,10-11H,8-9H2,1-3H3.
What are the key properties of 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline?
4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline has a molecular weight of 325.37 g/mol, XLogP of 2.18, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-(2-methoxyethoxy)pteridin-4-yl]-N,N-dimethylaniline is sourced from PubChem (CID 70676084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).