N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride

C19H28ClN3O3 — CID 119735145

IUPACN-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C1CNCCO1
InChIInChI=1S/C19H27N3O3.ClH/c23-18(7-6-15-4-2-1-3-5-15)22-11-8-16(9-12-22)21-19(24)17-14-20-10-13-25-17;/h1-5,16-17,20H,6-14H2,(H,21,24);1H
InChIKeyKFTNEUGOAKZLCD-UHFFFAOYSA-N
MW381.90 g/mol
LogP1.14
Rot. Bonds5

About N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride

N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119735145) has the molecular formula C19H28ClN3O3 and a molecular weight of 381.90 g/mol. Its IUPAC name is N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride
PubChem CID119735145
Molecular FormulaC19H28ClN3O3
Molecular Weight381.90 g/mol
Exact Mass381.18
IUPAC NameN-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C1CNCCO1
InChIInChI=1S/C19H27N3O3.ClH/c23-18(7-6-15-4-2-1-3-5-15)22-11-8-16(9-12-22)21-19(24)17-14-20-10-13-25-17;/h1-5,16-17,20H,6-14H2,(H,21,24);1H
InChIKeyKFTNEUGOAKZLCD-UHFFFAOYSA-N
XLogP1.14
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.90
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-benzylpiperidin-4-yl)morpholine-2-carboxamide
CID 119827619
N-[1-(3-phenylpropanoyl)piperidin-4-yl]cyclopropanecarboxamide
CID 110820836
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]morpholine-2-carboxamide
CID 119840351
5-oxo-N-[1-(3-phenylpropanoyl)piperidin-4-yl]pyrrolidine-2-carboxamide
CID 110820856
(2R,3S)-2-methyl-N-[1-(3-phenylpropanoyl)pyrrolidin-3-yl]morpholine-3-carboxamide
CID 120936054
N-[1-(4-methylbenzoyl)piperidin-4-yl]morpholine-2-carboxamide
CID 119770095
morpholin-2-yl-[4-(2-phenylethyl)piperidin-1-yl]methanone
CID 119698790
N-[1-(3-phenylpropanoyl)piperidin-4-yl]prop-2-enamide
CID 166406035
2,2,2-trifluoro-N-[1-(3-phenylpropanoyl)piperidin-4-yl]acetamide
CID 108548737
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[1-(3-phenylpropanoyl)piperidin-4-yl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119295776
N-[1-(3-methylphenyl)piperidin-4-yl]morpholine-2-carboxamide;dihydrochloride
CID 154903636

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride (CID 119735145) is N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride is Cl.O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C1CNCCO1.
What is the InChIKey of N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is KFTNEUGOAKZLCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3.ClH/c23-18(7-6-15-4-2-1-3-5-15)22-11-8-16(9-12-22)21-19(24)17-14-20-10-13-25-17;/h1-5,16-17,20H,6-14H2,(H,21,24);1H.
What are the key properties of N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride?
N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 381.90 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-phenylpropanoyl)piperidin-4-yl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119735145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).