2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine

C23H24N4O — CID 3233660

IUPAC2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
SMILESCN(C)Cc1ccccc1-c1nc(N(C)Cc2ccco2)c2ccccc2n1
InChIInChI=1S/C23H24N4O/c1-26(2)15-17-9-4-5-11-19(17)22-24-21-13-7-6-12-20(21)23(25-22)27(3)16-18-10-8-14-28-18/h4-14H,15-16H2,1-3H3
InChIKeyOVJDNWJWIBKTRG-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.59
Rot. Bonds6

About 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine

2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine (PubChem CID 3233660) has the molecular formula C23H24N4O and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine.

Molecular Properties

Compound Name2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
PubChem CID3233660
Molecular FormulaC23H24N4O
Molecular Weight372.47 g/mol
Exact Mass372.20
IUPAC Name2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine
SMILESCN(C)Cc1ccccc1-c1nc(N(C)Cc2ccco2)c2ccccc2n1
InChIInChI=1S/C23H24N4O/c1-26(2)15-17-9-4-5-11-19(17)22-24-21-13-7-6-12-20(21)23(25-22)27(3)16-18-10-8-14-28-18/h4-14H,15-16H2,1-3H3
InChIKeyOVJDNWJWIBKTRG-UHFFFAOYSA-N
XLogP4.59
TPSA45.40 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The IUPAC name of 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine (CID 3233660) is 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine.
What is the SMILES notation for 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The canonical SMILES for 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine is CN(C)Cc1ccccc1-c1nc(N(C)Cc2ccco2)c2ccccc2n1.
What is the InChIKey of 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
The InChIKey is OVJDNWJWIBKTRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O/c1-26(2)15-17-9-4-5-11-19(17)22-24-21-13-7-6-12-20(21)23(25-22)27(3)16-18-10-8-14-28-18/h4-14H,15-16H2,1-3H3.
What are the key properties of 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine?
2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine has a molecular weight of 372.47 g/mol, XLogP of 4.59, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(dimethylamino)methyl]phenyl]-N-(furan-2-ylmethyl)-N-methylquinazolin-4-amine is sourced from PubChem (CID 3233660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).