N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride

C17H21Cl2N3O3 — CID 119846119

IUPACN-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(Nc1cccc(OCc2ccccn2)c1)C1CNCCO1
InChIInChI=1S/C17H19N3O3.2ClH/c21-17(16-11-18-8-9-22-16)20-13-5-3-6-15(10-13)23-12-14-4-1-2-7-19-14;;/h1-7,10,16,18H,8-9,11-12H2,(H,20,21);2*1H
InChIKeySCNIAPDHKJIZAP-UHFFFAOYSA-N
MW386.28 g/mol
LogP2.43
Rot. Bonds5

About N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride

N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride (PubChem CID 119846119) has the molecular formula C17H21Cl2N3O3 and a molecular weight of 386.28 g/mol. Its IUPAC name is N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride
PubChem CID119846119
Molecular FormulaC17H21Cl2N3O3
Molecular Weight386.28 g/mol
Exact Mass385.10
IUPAC NameN-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(Nc1cccc(OCc2ccccn2)c1)C1CNCCO1
InChIInChI=1S/C17H19N3O3.2ClH/c21-17(16-11-18-8-9-22-16)20-13-5-3-6-15(10-13)23-12-14-4-1-2-7-19-14;;/h1-7,10,16,18H,8-9,11-12H2,(H,20,21);2*1H
InChIKeySCNIAPDHKJIZAP-UHFFFAOYSA-N
XLogP2.43
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.28
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119867098
N-(3-butoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119745760
N-[3-[(3-methylphenyl)methoxy]phenyl]morpholine-2-carboxamide
CID 119783770
N-[3-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]morpholine-2-carboxamide
CID 119713878
N-[3-(pyridin-2-ylmethoxy)phenyl]piperidine-2-carboxamide
CID 119846086
N-[3-(1,3-benzodioxol-5-yloxymethyl)phenyl]morpholine-2-carboxamide
CID 119729240
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027
N-(3-pyridin-2-ylpropyl)morpholine-2-carboxamide;dihydrochloride
CID 154911195
N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675709
N-quinoxalin-6-ylmorpholine-2-carboxamide;hydrochloride
CID 119708415
4-methoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]piperidine-4-carboxamide
CID 119846112
N-[3-(ethylcarbamoylamino)phenyl]morpholine-2-carboxamide
CID 119755895

Frequently Asked Questions

What is the IUPAC name of N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride?
The IUPAC name of N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride (CID 119846119) is N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride.
What is the SMILES notation for N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride?
The canonical SMILES for N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride is Cl.Cl.O=C(Nc1cccc(OCc2ccccn2)c1)C1CNCCO1.
What is the InChIKey of N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride?
The InChIKey is SCNIAPDHKJIZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3.2ClH/c21-17(16-11-18-8-9-22-16)20-13-5-3-6-15(10-13)23-12-14-4-1-2-7-19-14;;/h1-7,10,16,18H,8-9,11-12H2,(H,20,21);2*1H.
What are the key properties of N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride?
N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride has a molecular weight of 386.28 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(pyridin-2-ylmethoxy)phenyl]morpholine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119846119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).