4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine

C15H20N4 — CID 80848720

IUPAC4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine
SMILESCNc1nc(N2CC(C)C(C)C2)c2ccccc2n1
InChIInChI=1S/C15H20N4/c1-10-8-19(9-11(10)2)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18)
InChIKeyWNGYTPRXUCZHFC-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.76
Rot. Bonds2

About 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine

4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine (PubChem CID 80848720) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine.

Molecular Properties

Compound Name4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine
PubChem CID80848720
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine
SMILESCNc1nc(N2CC(C)C(C)C2)c2ccccc2n1
InChIInChI=1S/C15H20N4/c1-10-8-19(9-11(10)2)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18)
InChIKeyWNGYTPRXUCZHFC-UHFFFAOYSA-N
XLogP2.76
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine?
The IUPAC name of 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine (CID 80848720) is 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine.
What is the SMILES notation for 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine?
The canonical SMILES for 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine is CNc1nc(N2CC(C)C(C)C2)c2ccccc2n1.
What is the InChIKey of 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine?
The InChIKey is WNGYTPRXUCZHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-10-8-19(9-11(10)2)14-12-6-4-5-7-13(12)17-15(16-3)18-14/h4-7,10-11H,8-9H2,1-3H3,(H,16,17,18).
What are the key properties of 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine?
4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethylpyrrolidin-1-yl)-N-methylquinazolin-2-amine is sourced from PubChem (CID 80848720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).