N-methyl-N-prop-1-en-2-ylquinazolin-2-amine

C12H13N3 — CID 157035873

IUPACN-methyl-N-prop-1-en-2-ylquinazolin-2-amine
SMILESC=C(C)N(C)c1ncc2ccccc2n1
InChIInChI=1S/C12H13N3/c1-9(2)15(3)12-13-8-10-6-4-5-7-11(10)14-12/h4-8H,1H2,2-3H3
InChIKeyPLOKGNIBVDTWHI-UHFFFAOYSA-N
MW199.26 g/mol
LogP2.60
Rot. Bonds2

About N-methyl-N-prop-1-en-2-ylquinazolin-2-amine

N-methyl-N-prop-1-en-2-ylquinazolin-2-amine (PubChem CID 157035873) has the molecular formula C12H13N3 and a molecular weight of 199.26 g/mol. Its IUPAC name is N-methyl-N-prop-1-en-2-ylquinazolin-2-amine.

Molecular Properties

Compound NameN-methyl-N-prop-1-en-2-ylquinazolin-2-amine
PubChem CID157035873
Molecular FormulaC12H13N3
Molecular Weight199.26 g/mol
Exact Mass199.11
IUPAC NameN-methyl-N-prop-1-en-2-ylquinazolin-2-amine
SMILESC=C(C)N(C)c1ncc2ccccc2n1
InChIInChI=1S/C12H13N3/c1-9(2)15(3)12-13-8-10-6-4-5-7-11(10)14-12/h4-8H,1H2,2-3H3
InChIKeyPLOKGNIBVDTWHI-UHFFFAOYSA-N
XLogP2.60
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.26
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[methyl(quinazolin-2-yl)amino]propan-2-ol
CID 114789604
N-(2-chloroethyl)-N-methylquinazolin-2-amine
CID 114789805
N-ethyl-N'-methyl-N'-quinazolin-2-ylethane-1,2-diamine
CID 114789767
2,6-dimethylheptane;N-methyl-N-propan-2-ylquinazolin-2-amine
CID 167588136
methyl 4-[methyl(quinazolin-2-yl)amino]butanoate
CID 114789702
2-methyl-3-[methyl(quinazolin-2-yl)amino]propanethioamide
CID 114788724
1-N,4-dimethyl-1-N-quinazolin-2-ylpentane-1,3-diamine
CID 114789544
2-methylquinazoline
CID 588987
N-(2-bromocyclohexyl)-N-methylquinazolin-2-amine
CID 102637721
N'-ethyl-N'-quinazolin-2-ylpropane-1,3-diamine
CID 114788666
2-methylquinazoline;platinum
CID 140601163
ethane;2-methylquinazoline
CID 176988292

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-prop-1-en-2-ylquinazolin-2-amine?
The IUPAC name of N-methyl-N-prop-1-en-2-ylquinazolin-2-amine (CID 157035873) is N-methyl-N-prop-1-en-2-ylquinazolin-2-amine.
What is the SMILES notation for N-methyl-N-prop-1-en-2-ylquinazolin-2-amine?
The canonical SMILES for N-methyl-N-prop-1-en-2-ylquinazolin-2-amine is C=C(C)N(C)c1ncc2ccccc2n1.
What is the InChIKey of N-methyl-N-prop-1-en-2-ylquinazolin-2-amine?
The InChIKey is PLOKGNIBVDTWHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3/c1-9(2)15(3)12-13-8-10-6-4-5-7-11(10)14-12/h4-8H,1H2,2-3H3.
What are the key properties of N-methyl-N-prop-1-en-2-ylquinazolin-2-amine?
N-methyl-N-prop-1-en-2-ylquinazolin-2-amine has a molecular weight of 199.26 g/mol, XLogP of 2.60, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-1-en-2-ylquinazolin-2-amine is sourced from PubChem (CID 157035873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).