4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine

C23H22N6O — CID 95830959

IUPAC4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine
SMILESNc1cc(-c2cncnc2[C@H]2CN(Cc3cccc4cccnc34)CCO2)ccn1
InChIInChI=1S/C23H22N6O/c24-21-11-17(6-8-26-21)19-12-25-15-28-23(19)20-14-29(9-10-30-20)13-18-4-1-3-16-5-2-7-27-22(16)18/h1-8,11-12,15,20H,9-10,13-14H2,(H2,24,26)/t20-/m1/s1
InChIKeyHFROSCCUIGFOBY-HXUWFJFHSA-N
MW398.47 g/mol
LogP3.24
Rot. Bonds4

About 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine

4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine (PubChem CID 95830959) has the molecular formula C23H22N6O and a molecular weight of 398.47 g/mol. Its IUPAC name is 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine
PubChem CID95830959
Molecular FormulaC23H22N6O
Molecular Weight398.47 g/mol
Exact Mass398.19
IUPAC Name4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine
SMILESNc1cc(-c2cncnc2[C@H]2CN(Cc3cccc4cccnc34)CCO2)ccn1
InChIInChI=1S/C23H22N6O/c24-21-11-17(6-8-26-21)19-12-25-15-28-23(19)20-14-29(9-10-30-20)13-18-4-1-3-16-5-2-7-27-22(16)18/h1-8,11-12,15,20H,9-10,13-14H2,(H2,24,26)/t20-/m1/s1
InChIKeyHFROSCCUIGFOBY-HXUWFJFHSA-N
XLogP3.24
TPSA90.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine 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

[(2R)-2-[5-(2-amino-4-pyridinyl)pyrimidin-4-yl]morpholin-4-yl]-quinolin-5-ylmethanone
CID 95830957
1-[2-[5-(2-amino-4-pyridinyl)pyrimidin-4-yl]morpholin-4-yl]-3-(4-methylpiperidin-1-yl)propan-1-one
CID 110092846
N,N-dimethyl-2-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]quinoline-4-carboxamide
CID 92638317
(2R)-4-[(6-fluoroquinolin-8-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine
CID 95156923
(2S)-4-[(6-fluoroquinolin-8-yl)methyl]-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 129342775
4-[(2-methoxy-4-methylphenyl)methyl]-2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pyrimidin-4-yl]morpholine
CID 127250972
N-propan-2-yl-3-[4-(quinolin-8-ylmethyl)morpholin-2-yl]thieno[2,3-b]pyridine-2-carboxamide
CID 110259862
3-[4-(quinolin-6-ylmethyl)morpholin-2-yl]pyrazin-2-amine
CID 110112796
4-[(7-chloroquinolin-8-yl)methyl]-2-(3-fluorophenyl)morpholine
CID 86884183
2-isoquinolin-3-yl-4-[(2-methoxyphenyl)methyl]morpholine
CID 110218627
2-[5-(5-methyl-1,2,4-oxadiazol-3-yl)pyrimidin-4-yl]-4-[(2-methyl-1,3-thiazol-5-yl)methyl]morpholine
CID 110130724
8-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)quinoline
CID 78945122

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine?
The IUPAC name of 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine (CID 95830959) is 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine.
What is the SMILES notation for 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine?
The canonical SMILES for 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine is Nc1cc(-c2cncnc2[C@H]2CN(Cc3cccc4cccnc34)CCO2)ccn1.
What is the InChIKey of 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine?
The InChIKey is HFROSCCUIGFOBY-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H22N6O/c24-21-11-17(6-8-26-21)19-12-25-15-28-23(19)20-14-29(9-10-30-20)13-18-4-1-3-16-5-2-7-27-22(16)18/h1-8,11-12,15,20H,9-10,13-14H2,(H2,24,26)/t20-/m1/s1.
What are the key properties of 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine?
4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine has a molecular weight of 398.47 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(2R)-4-(quinolin-8-ylmethyl)morpholin-2-yl]pyrimidin-5-yl]pyridin-2-amine is sourced from PubChem (CID 95830959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).