N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride

C12H20Cl2N4O2 — CID 119863150

IUPACN-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride
SMILESCN(C)c1ccc(NC(=O)C2COCCN2)nc1.Cl.Cl
InChIInChI=1S/C12H18N4O2.2ClH/c1-16(2)9-3-4-11(14-7-9)15-12(17)10-8-18-6-5-13-10;;/h3-4,7,10,13H,5-6,8H2,1-2H3,(H,14,15,17);2*1H
InChIKeyBCMOSERPMFEGHS-UHFFFAOYSA-N
MW323.22 g/mol
LogP0.92
Rot. Bonds3

About N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride

N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride (PubChem CID 119863150) has the molecular formula C12H20Cl2N4O2 and a molecular weight of 323.22 g/mol. Its IUPAC name is N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride
PubChem CID119863150
Molecular FormulaC12H20Cl2N4O2
Molecular Weight323.22 g/mol
Exact Mass322.10
IUPAC NameN-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride
SMILESCN(C)c1ccc(NC(=O)C2COCCN2)nc1.Cl.Cl
InChIInChI=1S/C12H18N4O2.2ClH/c1-16(2)9-3-4-11(14-7-9)15-12(17)10-8-18-6-5-13-10;;/h3-4,7,10,13H,5-6,8H2,1-2H3,(H,14,15,17);2*1H
InChIKeyBCMOSERPMFEGHS-UHFFFAOYSA-N
XLogP0.92
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methylmorpholine-3-carboxamide
CID 120940037
N-(5-morpholin-4-yl-2-pyridinyl)morpholine-3-carboxamide
CID 119841975
N-(5-piperidin-1-yl-2-pyridinyl)morpholine-3-carboxamide
CID 119855637
N-[5-(dimethylamino)-2-pyridinyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;dihydrochloride
CID 119863170
N-(5-propan-2-yl-1H-pyrazol-3-yl)morpholine-3-carboxamide
CID 104618392
N-(6-bromo-3-pyridinyl)morpholine-3-carboxamide
CID 103813891
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(5-ethyl-1,3-thiazol-2-yl)morpholine-3-carboxamide
CID 119755286
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129000728
(2S,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methyloxane-3-carboxamide
CID 129400783
N-[3-(dimethylamino)-4-methylphenyl]morpholine-3-carboxamide
CID 115377301

Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride?
The IUPAC name of N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride (CID 119863150) is N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride is CN(C)c1ccc(NC(=O)C2COCCN2)nc1.Cl.Cl.
What is the InChIKey of N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride?
The InChIKey is BCMOSERPMFEGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2.2ClH/c1-16(2)9-3-4-11(14-7-9)15-12(17)10-8-18-6-5-13-10;;/h3-4,7,10,13H,5-6,8H2,1-2H3,(H,14,15,17);2*1H.
What are the key properties of N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride?
N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride has a molecular weight of 323.22 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylamino)-2-pyridinyl]morpholine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119863150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).