4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine

C14H19N3O2 — CID 106669175

IUPAC4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine
SMILESCOC(C)(C)CCOc1nc(N)nc2ccccc12
InChIInChI=1S/C14H19N3O2/c1-14(2,18-3)8-9-19-12-10-6-4-5-7-11(10)16-13(15)17-12/h4-7H,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyBCVAUCJBEILGHH-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.41
Rot. Bonds5

About 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine

4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine (PubChem CID 106669175) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine.

Molecular Properties

Compound Name4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine
PubChem CID106669175
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine
SMILESCOC(C)(C)CCOc1nc(N)nc2ccccc12
InChIInChI=1S/C14H19N3O2/c1-14(2,18-3)8-9-19-12-10-6-4-5-7-11(10)16-13(15)17-12/h4-7H,8-9H2,1-3H3,(H2,15,16,17)
InChIKeyBCVAUCJBEILGHH-UHFFFAOYSA-N
XLogP2.41
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Fenazaquin
CID 86356
2,4-Quinazolinediamine, 5-methoxy-
CID 213752
2,4-Quinazolinediamine, 5-ethoxy-
CID 461900
5-(2-Fluorobenzyloxy)quinazoline-2,4-diamine
CID 24778025
1-(4-Methoxy-6-methylquinazolin-2-yl)guanidine
CID 600062
4-Methoxyquinazoline
CID 27831
2-(Quinazolin-4-yloxy)acetic acid
CID 3148347
(7-Ethoxy-4-methylquinazolin-2-yl)(4,4,6-trimethyl-1,4-dihydropyrimidin-2-yl)amine
CID 658668
5-(4-Fluorophenoxy)quinazoline-2,4-diamine
CID 2824486
5-[(4-Methylbenzyl)oxy]quinazoline-2,4-diamine
CID 2824489
2-(7-Methoxy-4-methylquinazolin-2-yl)guanidine
CID 2835211
N-(8-ethoxy-4-methylquinazolin-2-yl)guanidine
CID 2840092

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine?
The IUPAC name of 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine (CID 106669175) is 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine.
What is the SMILES notation for 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine?
The canonical SMILES for 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine is COC(C)(C)CCOc1nc(N)nc2ccccc12.
What is the InChIKey of 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine?
The InChIKey is BCVAUCJBEILGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-14(2,18-3)8-9-19-12-10-6-4-5-7-11(10)16-13(15)17-12/h4-7H,8-9H2,1-3H3,(H2,15,16,17).
What are the key properties of 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine?
4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine has a molecular weight of 261.32 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-3-methylbutoxy)quinazolin-2-amine is sourced from PubChem (CID 106669175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).