(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine

C24H27N3O3 — CID 168795643

IUPAC(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine
SMILESCc1cc(Cc2ccc(C3OCCO3)nc2)c2cc(N3CCO[C@H](C)C3)ccc2n1
InChIInChI=1S/C24H27N3O3/c1-16-11-19(12-18-3-5-23(25-14-18)24-29-9-10-30-24)21-13-20(4-6-22(21)26-16)27-7-8-28-17(2)15-27/h3-6,11,13-14,17,24H,7-10,12,15H2,1-2H3/t17-/m1/s1
InChIKeyZXJKYNWZQGVHFI-QGZVFWFLSA-N
MW405.50 g/mol
LogP3.80
Rot. Bonds4

About (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine

(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine (PubChem CID 168795643) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine.

Molecular Properties

Compound Name(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine
PubChem CID168795643
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine
SMILESCc1cc(Cc2ccc(C3OCCO3)nc2)c2cc(N3CCO[C@H](C)C3)ccc2n1
InChIInChI=1S/C24H27N3O3/c1-16-11-19(12-18-3-5-23(25-14-18)24-29-9-10-30-24)21-13-20(4-6-22(21)26-16)27-7-8-28-17(2)15-27/h3-6,11,13-14,17,24H,7-10,12,15H2,1-2H3/t17-/m1/s1
InChIKeyZXJKYNWZQGVHFI-QGZVFWFLSA-N
XLogP3.80
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine 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

6-[2-[[4-(1,3-dioxolan-2-yl)anilino]methyl]-6-methylmorpholin-4-yl]-N-[6-(1,3-dioxolan-2-yl)-3-pyridinyl]-2-methylquinolin-4-amine
CID 170017299
[5-(2-methylmorpholin-4-yl)-2-pyridinyl]methanamine
CID 115486800
7-methyl-N-[[6-(2-methylmorpholin-4-yl)-3-pyridinyl]methyl]isoquinolin-1-amine
CID 166239118
4-[5-(chloromethyl)-3-methyl-2-pyridinyl]-2-methylmorpholine
CID 80628844
5-(2-methylmorpholin-4-yl)-2-[[3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methyl]pyridazin-3-one
CID 146272619
7-chloro-N-[[6-[(2S)-2-methylmorpholin-4-yl]-3-pyridinyl]methyl]quinolin-4-amine
CID 94424908
[2-fluoro-4-(2-methylmorpholin-4-yl)phenyl]methanamine
CID 115366639
2-methyl-4-(3-methyl-1H-pyrrolo[2,3-b]pyridin-5-yl)morpholine
CID 129162842
1-[6-(1,3-dioxolan-2-yl)-3-pyridinyl]piperazine
CID 130955693
N-methyl-1-[2-(2-methylmorpholin-4-yl)-3-pyridinyl]methanamine
CID 62285958
2-methyl-4-(2-methylpropyl)-6-pyrrolidin-1-ylquinoline
CID 170001559
1-[2-methyl-4-(2-methylmorpholin-4-yl)phenyl]butan-2-amine
CID 63787083

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine?
The IUPAC name of (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine (CID 168795643) is (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine.
What is the SMILES notation for (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine?
The canonical SMILES for (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine is Cc1cc(Cc2ccc(C3OCCO3)nc2)c2cc(N3CCO[C@H](C)C3)ccc2n1.
What is the InChIKey of (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine?
The InChIKey is ZXJKYNWZQGVHFI-QGZVFWFLSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-16-11-19(12-18-3-5-23(25-14-18)24-29-9-10-30-24)21-13-20(4-6-22(21)26-16)27-7-8-28-17(2)15-27/h3-6,11,13-14,17,24H,7-10,12,15H2,1-2H3/t17-/m1/s1.
What are the key properties of (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine?
(2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine has a molecular weight of 405.50 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[4-[[6-(1,3-dioxolan-2-yl)-3-pyridinyl]methyl]-2-methylquinolin-6-yl]-2-methylmorpholine is sourced from PubChem (CID 168795643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).