N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride

C14H19ClN2O3 — CID 119767335

IUPACN-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)CCCO2)C1COCCN1
InChIInChI=1S/C14H18N2O3.ClH/c17-14(12-9-18-7-5-15-12)16-11-3-4-13-10(8-11)2-1-6-19-13;/h3-4,8,12,15H,1-2,5-7,9H2,(H,16,17);1H
InChIKeyXPSLFHVECUWLJW-UHFFFAOYSA-N
MW298.77 g/mol
LogP1.36
Rot. Bonds2

About N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride

N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride (PubChem CID 119767335) has the molecular formula C14H19ClN2O3 and a molecular weight of 298.77 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride
PubChem CID119767335
Molecular FormulaC14H19ClN2O3
Molecular Weight298.77 g/mol
Exact Mass298.11
IUPAC NameN-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)CCCO2)C1COCCN1
InChIInChI=1S/C14H18N2O3.ClH/c17-14(12-9-18-7-5-15-12)16-11-3-4-13-10(8-11)2-1-6-19-13;/h3-4,8,12,15H,1-2,5-7,9H2,(H,16,17);1H
InChIKeyXPSLFHVECUWLJW-UHFFFAOYSA-N
XLogP1.36
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-difluoro-1,3-benzodioxol-5-yl)morpholine-3-carboxamide;hydrochloride
CID 119693674
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-(3,4-dihydro-2H-chromen-6-yl)morpholine-2-carboxamide;hydrochloride
CID 119767367
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415
N-[3-(dimethylamino)-4-methylphenyl]morpholine-3-carboxamide
CID 115377301
N-(3,4-dihydro-2H-chromen-6-yl)carbamoyl bromide
CID 115193294
N-(3,4-dihydro-2H-chromen-6-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119767368
N-(3-carbamoylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119687667
N-(3,4-dihydro-2H-chromen-6-yl)-2-sulfanylacetamide
CID 115166948
N-[4-(2-methylpropanoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119685241

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride (CID 119767335) is N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride is Cl.O=C(Nc1ccc2c(c1)CCCO2)C1COCCN1.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride?
The InChIKey is XPSLFHVECUWLJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3.ClH/c17-14(12-9-18-7-5-15-12)16-11-3-4-13-10(8-11)2-1-6-19-13;/h3-4,8,12,15H,1-2,5-7,9H2,(H,16,17);1H.
What are the key properties of N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride?
N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride has a molecular weight of 298.77 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-6-yl)morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119767335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).