N,N-dimethyl-1,4-dihydroquinazolin-2-amine

C10H13N3 — CID 12683497

IUPACN,N-dimethyl-1,4-dihydroquinazolin-2-amine
SMILESCN(C)C1=NCc2ccccc2N1
InChIInChI=1S/C10H13N3/c1-13(2)10-11-7-8-5-3-4-6-9(8)12-10/h3-6H,7H2,1-2H3,(H,11,12)
InChIKeyMNTBAXGKERZVOZ-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.53
Rot. Bonds

About N,N-dimethyl-1,4-dihydroquinazolin-2-amine

N,N-dimethyl-1,4-dihydroquinazolin-2-amine (PubChem CID 12683497) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is N,N-dimethyl-1,4-dihydroquinazolin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-1,4-dihydroquinazolin-2-amine
PubChem CID12683497
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC NameN,N-dimethyl-1,4-dihydroquinazolin-2-amine
SMILESCN(C)C1=NCc2ccccc2N1
InChIInChI=1S/C10H13N3/c1-13(2)10-11-7-8-5-3-4-6-9(8)12-10/h3-6H,7H2,1-2H3,(H,11,12)
InChIKeyMNTBAXGKERZVOZ-UHFFFAOYSA-N
XLogP1.53
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1,4-dihydroquinazolin-2-amine?
The IUPAC name of N,N-dimethyl-1,4-dihydroquinazolin-2-amine (CID 12683497) is N,N-dimethyl-1,4-dihydroquinazolin-2-amine.
What is the SMILES notation for N,N-dimethyl-1,4-dihydroquinazolin-2-amine?
The canonical SMILES for N,N-dimethyl-1,4-dihydroquinazolin-2-amine is CN(C)C1=NCc2ccccc2N1.
What is the InChIKey of N,N-dimethyl-1,4-dihydroquinazolin-2-amine?
The InChIKey is MNTBAXGKERZVOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-13(2)10-11-7-8-5-3-4-6-9(8)12-10/h3-6H,7H2,1-2H3,(H,11,12).
What are the key properties of N,N-dimethyl-1,4-dihydroquinazolin-2-amine?
N,N-dimethyl-1,4-dihydroquinazolin-2-amine has a molecular weight of 175.23 g/mol, XLogP of 1.53, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1,4-dihydroquinazolin-2-amine is sourced from PubChem (CID 12683497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).