N-ethyl-4-propoxyquinazolin-2-amine

C13H17N3O — CID 80867291

IUPACN-ethyl-4-propoxyquinazolin-2-amine
SMILESCCCOc1nc(NCC)nc2ccccc12
InChIInChI=1S/C13H17N3O/c1-3-9-17-12-10-7-5-6-8-11(10)15-13(16-12)14-4-2/h5-8H,3-4,9H2,1-2H3,(H,14,15,16)
InChIKeyBVKGMCJNEGFSCX-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.85
Rot. Bonds5

About N-ethyl-4-propoxyquinazolin-2-amine

N-ethyl-4-propoxyquinazolin-2-amine (PubChem CID 80867291) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-ethyl-4-propoxyquinazolin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-propoxyquinazolin-2-amine
PubChem CID80867291
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-ethyl-4-propoxyquinazolin-2-amine
SMILESCCCOc1nc(NCC)nc2ccccc12
InChIInChI=1S/C13H17N3O/c1-3-9-17-12-10-7-5-6-8-11(10)15-13(16-12)14-4-2/h5-8H,3-4,9H2,1-2H3,(H,14,15,16)
InChIKeyBVKGMCJNEGFSCX-UHFFFAOYSA-N
XLogP2.85
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-propoxyquinazolin-2-yl)methanesulfonamide
CID 69085012
4-[2-(dimethylamino)-2-methylpropoxy]-N-ethylquinazolin-2-amine
CID 80871922
4-(3-methoxypropoxy)-N-propylquinazolin-2-amine
CID 80866995
4-hexoxy-N-methylquinazolin-2-amine
CID 80860948
2-chloro-4-propoxyquinazoline
CID 62477512
N-ethyl-4-(4-iodophenoxy)quinazolin-2-amine
CID 80875106
N-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]quinazolin-2-amine
CID 115943140
4-(2-methylpentoxy)-N-propylquinazolin-2-amine
CID 103286409
4-ethoxy-N-phenylquinazolin-2-amine
CID 134868632
4-[(5-chloro-3-pyridinyl)oxy]-N-ethylquinazolin-2-amine
CID 80870580
2-N-ethyl-4-N,4-N-dipropylquinazoline-2,4-diamine
CID 80763784
4-[3-(dimethylamino)propoxy]-N-methylquinazolin-2-amine
CID 80870725

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-propoxyquinazolin-2-amine?
The IUPAC name of N-ethyl-4-propoxyquinazolin-2-amine (CID 80867291) is N-ethyl-4-propoxyquinazolin-2-amine.
What is the SMILES notation for N-ethyl-4-propoxyquinazolin-2-amine?
The canonical SMILES for N-ethyl-4-propoxyquinazolin-2-amine is CCCOc1nc(NCC)nc2ccccc12.
What is the InChIKey of N-ethyl-4-propoxyquinazolin-2-amine?
The InChIKey is BVKGMCJNEGFSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-3-9-17-12-10-7-5-6-8-11(10)15-13(16-12)14-4-2/h5-8H,3-4,9H2,1-2H3,(H,14,15,16).
What are the key properties of N-ethyl-4-propoxyquinazolin-2-amine?
N-ethyl-4-propoxyquinazolin-2-amine has a molecular weight of 231.30 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-propoxyquinazolin-2-amine is sourced from PubChem (CID 80867291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).