(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone

C23H26N4O3 — CID 23987470

IUPAC(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone
SMILESCCCCc1ccc(C(=O)N2CCOC(COc3ncnc4ccccc34)C2)nc1
InChIInChI=1S/C23H26N4O3/c1-2-3-6-17-9-10-21(24-13-17)23(28)27-11-12-29-18(14-27)15-30-22-19-7-4-5-8-20(19)25-16-26-22/h4-5,7-10,13,16,18H,2-3,6,11-12,14-15H2,1H3
InChIKeyRLUOJIHKNTVQPD-UHFFFAOYSA-N
MW406.49 g/mol
LogP3.29
Rot. Bonds7

About (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone

(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone (PubChem CID 23987470) has the molecular formula C23H26N4O3 and a molecular weight of 406.49 g/mol. Its IUPAC name is (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone
PubChem CID23987470
Molecular FormulaC23H26N4O3
Molecular Weight406.49 g/mol
Exact Mass406.20
IUPAC Name(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone
SMILESCCCCc1ccc(C(=O)N2CCOC(COc3ncnc4ccccc34)C2)nc1
InChIInChI=1S/C23H26N4O3/c1-2-3-6-17-9-10-21(24-13-17)23(28)27-11-12-29-18(14-27)15-30-22-19-7-4-5-8-20(19)25-16-26-22/h4-5,7-10,13,16,18H,2-3,6,11-12,14-15H2,1H3
InChIKeyRLUOJIHKNTVQPD-UHFFFAOYSA-N
XLogP3.29
TPSA77.44 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.49
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[4-(5-butylpyridine-2-carbonyl)morpholin-2-yl]methoxy]-2,3-dihydroinden-1-one
CID 74224455
[5-(2-phenylethynyl)furan-2-yl]-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone
CID 5008151
4,6-dimethyl-5-[2-(quinazolin-4-yloxymethyl)morpholine-4-carbonyl]pyran-2-one
CID 74224302
(6-chloro-2H-chromen-3-yl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone
CID 3800574
3-(1,3-benzothiazol-2-ylsulfanyl)-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]propan-1-one
CID 3429619
N-(1,3-benzodioxol-5-ylmethyl)-2-(quinazolin-4-yloxymethyl)morpholine-4-carbothioamide
CID 3372354
(5-amino-2-pyridinyl)-(2-ethylmorpholin-4-yl)methanone
CID 81317078
3-(3-bromo-4-fluorophenyl)-1-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]prop-2-en-1-one
CID 3855774
N-[(2-fluorophenyl)methyl]-2-(quinazolin-4-yloxymethyl)morpholine-4-carbothioamide
CID 5016399
N-(4-butylphenyl)-2-(methoxymethyl)morpholine-4-carboxamide
CID 71992880
6-(2-ethylmorpholine-4-carbonyl)-N'-hydroxypyridine-3-carboximidamide
CID 76951823
tris(5-butylpyridine-2-carboxylic acid);iron
CID 91867238

Frequently Asked Questions

What is the IUPAC name of (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone?
The IUPAC name of (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone (CID 23987470) is (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone?
The canonical SMILES for (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone is CCCCc1ccc(C(=O)N2CCOC(COc3ncnc4ccccc34)C2)nc1.
What is the InChIKey of (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone?
The InChIKey is RLUOJIHKNTVQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O3/c1-2-3-6-17-9-10-21(24-13-17)23(28)27-11-12-29-18(14-27)15-30-22-19-7-4-5-8-20(19)25-16-26-22/h4-5,7-10,13,16,18H,2-3,6,11-12,14-15H2,1H3.
What are the key properties of (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone?
(5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone has a molecular weight of 406.49 g/mol, XLogP of 3.29, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-butyl-2-pyridinyl)-[2-(quinazolin-4-yloxymethyl)morpholin-4-yl]methanone is sourced from PubChem (CID 23987470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).