4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline

C15H17N3 — CID 175409443

IUPAC4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline
SMILESCC=CN1CCC(c2ncnc3ccccc23)C1
InChIInChI=1S/C15H17N3/c1-2-8-18-9-7-12(10-18)15-13-5-3-4-6-14(13)16-11-17-15/h2-6,8,11-12H,7,9-10H2,1H3
InChIKeyLUEAYLPQZKMPEX-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.95
Rot. Bonds2

About 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline

4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline (PubChem CID 175409443) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline.

Molecular Properties

Compound Name4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline
PubChem CID175409443
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline
SMILESCC=CN1CCC(c2ncnc3ccccc23)C1
InChIInChI=1S/C15H17N3/c1-2-8-18-9-7-12(10-18)15-13-5-3-4-6-14(13)16-11-17-15/h2-6,8,11-12H,7,9-10H2,1H3
InChIKeyLUEAYLPQZKMPEX-UHFFFAOYSA-N
XLogP2.95
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-N-methyl-3-quinazolin-4-ylpyrrolidine-1-sulfonamide
CID 155957936
2-methyl-3-[6-(3-quinazolin-4-ylpyrrolidin-1-yl)purin-9-yl]propan-1-ol
CID 167880070
N-(4-propan-2-ylphenyl)-2-(4-quinazolin-4-ylpiperidin-1-yl)acetamide
CID 58770643
N-(4-chlorophenyl)acetamide;4-cyclohexylquinazoline
CID 145078398
N-[4-(6,7-dimethoxyquinazolin-4-yl)piperidin-1-yl]-N-phenylformamide
CID 174565011
benzene;4-methylquinazoline
CID 174274782
4-(3-chloro-4-methylpiperidin-1-yl)quinazoline
CID 102960852
4-[(1-methylpiperidin-4-yl)methyl]quinazoline
CID 20709663
N-[(1-quinazolin-4-ylpiperidin-3-yl)methyl]ethanamine
CID 62593559
fluoromethane;4-methylquinazoline
CID 91079443
(3S)-3-phenylpyrrolidine-1-carbaldehyde
CID 175059746
4-(3-chloropiperidin-1-yl)quinazoline
CID 55184238

Frequently Asked Questions

What is the IUPAC name of 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline?
The IUPAC name of 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline (CID 175409443) is 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline.
What is the SMILES notation for 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline?
The canonical SMILES for 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline is CC=CN1CCC(c2ncnc3ccccc23)C1.
What is the InChIKey of 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline?
The InChIKey is LUEAYLPQZKMPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-8-18-9-7-12(10-18)15-13-5-3-4-6-14(13)16-11-17-15/h2-6,8,11-12H,7,9-10H2,1H3.
What are the key properties of 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline?
4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline has a molecular weight of 239.32 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-prop-1-enylpyrrolidin-3-yl)quinazoline is sourced from PubChem (CID 175409443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).