4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine

C15H20N4O — CID 64588529

IUPAC4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine
SMILESCN1CCCC1CCOc1ncnc2ccc(N)cc12
InChIInChI=1S/C15H20N4O/c1-19-7-2-3-12(19)6-8-20-15-13-9-11(16)4-5-14(13)17-10-18-15/h4-5,9-10,12H,2-3,6-8,16H2,1H3
InChIKeyYMPWJDYQABZRBO-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.08
Rot. Bonds4

About 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine

4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine (PubChem CID 64588529) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine.

Molecular Properties

Compound Name4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine
PubChem CID64588529
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine
SMILESCN1CCCC1CCOc1ncnc2ccc(N)cc12
InChIInChI=1S/C15H20N4O/c1-19-7-2-3-12(19)6-8-20-15-13-9-11(16)4-5-14(13)17-10-18-15/h4-5,9-10,12H,2-3,6-8,16H2,1H3
InChIKeyYMPWJDYQABZRBO-UHFFFAOYSA-N
XLogP2.08
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-propoxyquinazolin-6-amine
CID 64587338
2-[2-(1-methylpyrrolidin-2-yl)ethoxy]-1,3-benzothiazol-6-amine
CID 55173608
4-[2-(2-methoxyethoxy)ethoxy]quinazolin-6-amine
CID 104559985
3-chloro-4-[2-(1-methylpyrrolidin-2-yl)ethoxy]aniline
CID 61102885
4-bromo-3-[2-(1-methylpiperidin-2-yl)ethoxy]aniline
CID 107911011
5-amino-2-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridine-3-carbonitrile
CID 61100632
4-methoxy-6-[4-[2-(1-methylpiperidin-2-yl)ethyl]piperazin-1-yl]quinazoline
CID 126894851
4-(oxolan-2-ylmethoxy)quinazolin-6-amine
CID 64590316
4-chloro-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-5-propan-2-ylpyrimidine
CID 55231010
4-(2-methylpropoxy)quinazolin-6-amine
CID 64590117
N-ethyl-6-[2-(1-methylpyrrolidin-2-yl)ethoxy]-5-propylpyrimidin-4-amine
CID 80879280
4-[2-(1-methylpyrrolidin-2-yl)ethoxy]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 81222869

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine?
The IUPAC name of 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine (CID 64588529) is 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine.
What is the SMILES notation for 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine?
The canonical SMILES for 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine is CN1CCCC1CCOc1ncnc2ccc(N)cc12.
What is the InChIKey of 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine?
The InChIKey is YMPWJDYQABZRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-19-7-2-3-12(19)6-8-20-15-13-9-11(16)4-5-14(13)17-10-18-15/h4-5,9-10,12H,2-3,6-8,16H2,1H3.
What are the key properties of 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine?
4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine has a molecular weight of 272.35 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-methylpyrrolidin-2-yl)ethoxy]quinazolin-6-amine is sourced from PubChem (CID 64588529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).