N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride

C15H20ClN3O3 — CID 119700164

IUPACN-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(NC(=O)C2CNCCO2)cc1)C1CC1
InChIInChI=1S/C15H19N3O3.ClH/c19-14(10-1-2-10)17-11-3-5-12(6-4-11)18-15(20)13-9-16-7-8-21-13;/h3-6,10,13,16H,1-2,7-9H2,(H,17,19)(H,18,20);1H
InChIKeyXBWIYVIMJDMJRS-UHFFFAOYSA-N
MW325.80 g/mol
LogP1.38
Rot. Bonds4

About N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride

N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119700164) has the molecular formula C15H20ClN3O3 and a molecular weight of 325.80 g/mol. Its IUPAC name is N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119700164
Molecular FormulaC15H20ClN3O3
Molecular Weight325.80 g/mol
Exact Mass325.12
IUPAC NameN-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(NC(=O)C2CNCCO2)cc1)C1CC1
InChIInChI=1S/C15H19N3O3.ClH/c19-14(10-1-2-10)17-11-3-5-12(6-4-11)18-15(20)13-9-16-7-8-21-13;/h3-6,10,13,16H,1-2,7-9H2,(H,17,19)(H,18,20);1H
InChIKeyXBWIYVIMJDMJRS-UHFFFAOYSA-N
XLogP1.38
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119670966
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3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
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2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 80549799
N-[4-(2-amino-2-oxoethoxy)phenyl]morpholine-2-carboxamide;hydrochloride
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CID 119712395
N-(4-pentylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119686937
N-[4-[3-(dimethylamino)propanoylamino]phenyl]morpholine-2-carboxamide;dihydrochloride
CID 119868290
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119794532
N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119701987
N-(6-fluoro-3-pyridinyl)morpholine-2-carboxamide
CID 103808720
N-[4-(oxolane-2-carbonylamino)phenyl]piperidine-3-carboxamide
CID 119282784

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride (CID 119700164) is N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(NC(=O)C2CNCCO2)cc1)C1CC1.
What is the InChIKey of N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is XBWIYVIMJDMJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3.ClH/c19-14(10-1-2-10)17-11-3-5-12(6-4-11)18-15(20)13-9-16-7-8-21-13;/h3-6,10,13,16H,1-2,7-9H2,(H,17,19)(H,18,20);1H.
What are the key properties of N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride?
N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 325.80 g/mol, XLogP of 1.38, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119700164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).