(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone

C21H21N3O3 — CID 95555521

IUPAC(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
SMILESCOc1ccc2cc([C@H]3CN(C(=O)c4ccnc(N)c4)CCO3)ccc2c1
InChIInChI=1S/C21H21N3O3/c1-26-18-5-4-14-10-16(3-2-15(14)11-18)19-13-24(8-9-27-19)21(25)17-6-7-23-20(22)12-17/h2-7,10-12,19H,8-9,13H2,1H3,(H2,22,23)/t19-/m1/s1
InChIKeyRXJNMQPCONNWGJ-LJQANCHMSA-N
MW363.42 g/mol
LogP3.04
Rot. Bonds3

About (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone

(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone (PubChem CID 95555521) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
PubChem CID95555521
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC Name(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
SMILESCOc1ccc2cc([C@H]3CN(C(=O)c4ccnc(N)c4)CCO3)ccc2c1
InChIInChI=1S/C21H21N3O3/c1-26-18-5-4-14-10-16(3-2-15(14)11-18)19-13-24(8-9-27-19)21(25)17-6-7-23-20(22)12-17/h2-7,10-12,19H,8-9,13H2,1H3,(H2,22,23)/t19-/m1/s1
InChIKeyRXJNMQPCONNWGJ-LJQANCHMSA-N
XLogP3.04
TPSA77.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)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

[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 56874345
(4-hydroxy-3-methoxyphenyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95550019
[3-(hydroxymethyl)phenyl]-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95468929
(5-hydroxy-2-pyridinyl)-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone
CID 95555607
(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327180
[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-(5-propan-2-yl-1,2-oxazol-3-yl)methanone
CID 56875502
3-amino-1-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]propan-1-one;hydrochloride
CID 154892310
1-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]butane-1,2-dione
CID 95562775
1-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]butane-1,2-dione
CID 95562776
(1-aminocyclobutyl)-[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone;hydrochloride
CID 154924796
1,3-benzodioxol-5-yl-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327211
[2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]-(oxan-4-yl)methanone
CID 56866342

Frequently Asked Questions

What is the IUPAC name of (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The IUPAC name of (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone (CID 95555521) is (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone.
What is the SMILES notation for (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The canonical SMILES for (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone is COc1ccc2cc([C@H]3CN(C(=O)c4ccnc(N)c4)CCO3)ccc2c1.
What is the InChIKey of (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
The InChIKey is RXJNMQPCONNWGJ-LJQANCHMSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-26-18-5-4-14-10-16(3-2-15(14)11-18)19-13-24(8-9-27-19)21(25)17-6-7-23-20(22)12-17/h2-7,10-12,19H,8-9,13H2,1H3,(H2,22,23)/t19-/m1/s1.
What are the key properties of (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone?
(2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone has a molecular weight of 363.42 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-4-pyridinyl)-[(2S)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]methanone is sourced from PubChem (CID 95555521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).