1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one

C24H25ClN4O2 — CID 124986015

IUPAC1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one
SMILESCc1cc(-c2ccc(N)nc2)cc([C@H]2CN(C(=O)CCc3cccc(Cl)c3)CCO2)n1
InChIInChI=1S/C24H25ClN4O2/c1-16-11-19(18-6-7-23(26)27-14-18)13-21(28-16)22-15-29(9-10-31-22)24(30)8-5-17-3-2-4-20(25)12-17/h2-4,6-7,11-14,22H,5,8-10,15H2,1H3,(H2,26,27)/t22-/m1/s1
InChIKeyNVRSWRAZTJLXTF-JOCHJYFZSA-N
MW436.94 g/mol
LogP4.22
Rot. Bonds5

About 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one

1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one (PubChem CID 124986015) has the molecular formula C24H25ClN4O2 and a molecular weight of 436.94 g/mol. Its IUPAC name is 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one.

Molecular Properties

Compound Name1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one
PubChem CID124986015
Molecular FormulaC24H25ClN4O2
Molecular Weight436.94 g/mol
Exact Mass436.17
IUPAC Name1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one
SMILESCc1cc(-c2ccc(N)nc2)cc([C@H]2CN(C(=O)CCc3cccc(Cl)c3)CCO2)n1
InChIInChI=1S/C24H25ClN4O2/c1-16-11-19(18-6-7-23(26)27-14-18)13-21(28-16)22-15-29(9-10-31-22)24(30)8-5-17-3-2-4-20(25)12-17/h2-4,6-7,11-14,22H,5,8-10,15H2,1H3,(H2,26,27)/t22-/m1/s1
InChIKeyNVRSWRAZTJLXTF-JOCHJYFZSA-N
XLogP4.22
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.94
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one?
The IUPAC name of 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one (CID 124986015) is 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one.
What is the SMILES notation for 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one?
The canonical SMILES for 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one is Cc1cc(-c2ccc(N)nc2)cc([C@H]2CN(C(=O)CCc3cccc(Cl)c3)CCO2)n1.
What is the InChIKey of 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one?
The InChIKey is NVRSWRAZTJLXTF-JOCHJYFZSA-N. The full InChI is InChI=1S/C24H25ClN4O2/c1-16-11-19(18-6-7-23(26)27-14-18)13-21(28-16)22-15-29(9-10-31-22)24(30)8-5-17-3-2-4-20(25)12-17/h2-4,6-7,11-14,22H,5,8-10,15H2,1H3,(H2,26,27)/t22-/m1/s1.
What are the key properties of 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one?
1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one has a molecular weight of 436.94 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-[4-(6-amino-3-pyridinyl)-6-methyl-2-pyridinyl]morpholin-4-yl]-3-(3-chlorophenyl)propan-1-one is sourced from PubChem (CID 124986015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).