4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine

C17H24N4 — CID 80774231

IUPAC4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine
SMILESCCCNc1nc(N(C)C(C)C2CC2)c2ccccc2n1
InChIInChI=1S/C17H24N4/c1-4-11-18-17-19-15-8-6-5-7-14(15)16(20-17)21(3)12(2)13-9-10-13/h5-8,12-13H,4,9-11H2,1-3H3,(H,18,19,20)
InChIKeyHOCCZKIBJWKDGJ-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.69
Rot. Bonds6

About 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine

4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine (PubChem CID 80774231) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine.

Molecular Properties

Compound Name4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine
PubChem CID80774231
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine
SMILESCCCNc1nc(N(C)C(C)C2CC2)c2ccccc2n1
InChIInChI=1S/C17H24N4/c1-4-11-18-17-19-15-8-6-5-7-14(15)16(20-17)21(3)12(2)13-9-10-13/h5-8,12-13H,4,9-11H2,1-3H3,(H,18,19,20)
InChIKeyHOCCZKIBJWKDGJ-UHFFFAOYSA-N
XLogP3.69
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N,4-N-dimethyl-2-N-propylquinazoline-2,4-diamine
CID 80765400
2-N-ethyl-4-N-methyl-4-N-(3-methylbutan-2-yl)quinazoline-2,4-diamine
CID 80793521
N-(1-cyclopropylethyl)-3-(ethylaminomethyl)-N-methylisoquinolin-1-amine
CID 62283095
3-(chloromethyl)-N-(1-cyclopropylethyl)-N-methylisoquinolin-1-amine
CID 61257014
3-[[2-(ethylamino)quinazolin-4-yl]-methylamino]butanenitrile
CID 80828170
N-butan-2-yl-2-hydrazinyl-N-methylquinazolin-4-amine
CID 80894230
4-N-(cyclopropylmethyl)-2-N-ethyl-4-N-propan-2-ylquinazoline-2,4-diamine
CID 80786859
4-N-(3-methylbutan-2-yl)-2-N-propylquinazoline-2,4-diamine
CID 80753533
2-N-ethyl-4-N-methyl-4-N-(2-methylpropyl)quinazoline-2,4-diamine
CID 80776501
2-N,4-N-dimethyl-4-N-pentan-3-ylquinazoline-2,4-diamine
CID 80792804
2-[(2-hydrazinylquinazolin-4-yl)-methylamino]propan-1-ol
CID 104557153
2-N,4-N-diethyl-4-N-propan-2-ylquinazoline-2,4-diamine
CID 80776424

Frequently Asked Questions

What is the IUPAC name of 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine?
The IUPAC name of 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine (CID 80774231) is 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine.
What is the SMILES notation for 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine?
The canonical SMILES for 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine is CCCNc1nc(N(C)C(C)C2CC2)c2ccccc2n1.
What is the InChIKey of 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine?
The InChIKey is HOCCZKIBJWKDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-4-11-18-17-19-15-8-6-5-7-14(15)16(20-17)21(3)12(2)13-9-10-13/h5-8,12-13H,4,9-11H2,1-3H3,(H,18,19,20).
What are the key properties of 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine?
4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine has a molecular weight of 284.41 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(1-cyclopropylethyl)-4-N-methyl-2-N-propylquinazoline-2,4-diamine is sourced from PubChem (CID 80774231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).