(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride

C15H26Cl2N4O2 — CID 120938917

IUPAC(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride
SMILESCCN(CC)c1ccc(NC(=O)[C@H]2NCCO[C@@H]2C)cn1.Cl.Cl
InChIInChI=1S/C15H24N4O2.2ClH/c1-4-19(5-2)13-7-6-12(10-17-13)18-15(20)14-11(3)21-9-8-16-14;;/h6-7,10-11,14,16H,4-5,8-9H2,1-3H3,(H,18,20);2*1H/t11-,14+;;/m1../s1
InChIKeyJFMBUWQZXBLMCX-LDDNZVBMSA-N
MW365.31 g/mol
LogP2.09
Rot. Bonds5

About (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride

(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride (PubChem CID 120938917) has the molecular formula C15H26Cl2N4O2 and a molecular weight of 365.31 g/mol. Its IUPAC name is (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound Name(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride
PubChem CID120938917
Molecular FormulaC15H26Cl2N4O2
Molecular Weight365.31 g/mol
Exact Mass364.14
IUPAC Name(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride
SMILESCCN(CC)c1ccc(NC(=O)[C@H]2NCCO[C@@H]2C)cn1.Cl.Cl
InChIInChI=1S/C15H24N4O2.2ClH/c1-4-19(5-2)13-7-6-12(10-17-13)18-15(20)14-11(3)21-9-8-16-14;;/h6-7,10-11,14,16H,4-5,8-9H2,1-3H3,(H,18,20);2*1H/t11-,14+;;/m1../s1
InChIKeyJFMBUWQZXBLMCX-LDDNZVBMSA-N
XLogP2.09
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.31
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride 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,3S)-N-(4-acetamidophenyl)-2-methylmorpholine-3-carboxamide
CID 120916743
(2R,3S)-2-methyl-N-(6-morpholin-4-yl-3-pyridinyl)morpholine-3-carboxamide
CID 120938472
(2R,3S)-N-(4-iodophenyl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120917297
(2R,3S)-2-methyl-N-pyridin-3-ylmorpholine-3-carboxamide
CID 120937694
N-[6-(diethylamino)-3-pyridinyl]piperidine-2-carboxamide
CID 43705952
(2R,3S)-2-methyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridinyl]morpholine-3-carboxamide
CID 120938926
(2R,3S)-N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-methylmorpholine-3-carboxamide
CID 120939088
(2R,3S)-N-[3-[2-(diethylamino)-2-oxoethoxy]phenyl]-2-methylmorpholine-3-carboxamide
CID 120922885
(2R,3S)-N-[3-chloro-4-[2-(diethylamino)-2-oxoethoxy]phenyl]-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120923488
(2R,3S)-N-(3-hydroxy-2-pyridinyl)-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120943026
(2R,3S)-N-(4-ethoxy-3-fluorophenyl)-2-methylmorpholine-3-carboxamide
CID 120926803
(2R,3S)-N-[4-(3-amino-3-oxopropoxy)phenyl]-2-methylmorpholine-3-carboxamide;hydrochloride
CID 120925642

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride?
The IUPAC name of (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride (CID 120938917) is (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride.
What is the SMILES notation for (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride?
The canonical SMILES for (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride is CCN(CC)c1ccc(NC(=O)[C@H]2NCCO[C@@H]2C)cn1.Cl.Cl.
What is the InChIKey of (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride?
The InChIKey is JFMBUWQZXBLMCX-LDDNZVBMSA-N. The full InChI is InChI=1S/C15H24N4O2.2ClH/c1-4-19(5-2)13-7-6-12(10-17-13)18-15(20)14-11(3)21-9-8-16-14;;/h6-7,10-11,14,16H,4-5,8-9H2,1-3H3,(H,18,20);2*1H/t11-,14+;;/m1../s1.
What are the key properties of (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride?
(2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride has a molecular weight of 365.31 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-N-[6-(diethylamino)-3-pyridinyl]-2-methylmorpholine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 120938917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).