N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride

C18H27ClN2O2 — CID 119799553

IUPACN-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride
SMILESCC(c1ccccc1)N(CC1CCC1)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C18H26N2O2.ClH/c1-14(16-8-3-2-4-9-16)20(13-15-6-5-7-15)18(21)17-12-19-10-11-22-17;/h2-4,8-9,14-15,17,19H,5-7,10-13H2,1H3;1H
InChIKeyHPEOJUOXYFMYFX-UHFFFAOYSA-N
MW338.88 g/mol
LogP2.79
Rot. Bonds5

About N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride

N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride (PubChem CID 119799553) has the molecular formula C18H27ClN2O2 and a molecular weight of 338.88 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride
PubChem CID119799553
Molecular FormulaC18H27ClN2O2
Molecular Weight338.88 g/mol
Exact Mass338.18
IUPAC NameN-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride
SMILESCC(c1ccccc1)N(CC1CCC1)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C18H26N2O2.ClH/c1-14(16-8-3-2-4-9-16)20(13-15-6-5-7-15)18(21)17-12-19-10-11-22-17;/h2-4,8-9,14-15,17,19H,5-7,10-13H2,1H3;1H
InChIKeyHPEOJUOXYFMYFX-UHFFFAOYSA-N
XLogP2.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.88
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-butan-2-ylmorpholine-2-carboxamide;hydrochloride
CID 119688848
3-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119799535
4-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)butanamide;hydrochloride
CID 119332710
N-(cyclobutylmethyl)-N-(1-phenylethyl)-3-piperidin-4-ylbutanamide
CID 119799552
4-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)butanamide
CID 119332711
1-(cyclobutylmethyl)-3-(4-hydroxycyclohexyl)-1-(1-phenylethyl)urea
CID 111450422
(2R)-N-[(1-benzylpiperidin-4-yl)methyl]-N-methylmorpholine-2-carboxamide
CID 96579373
N-cyclopropyl-N-(3-methylbutyl)morpholine-2-carboxamide;hydrochloride
CID 119728977
3-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)benzamide;hydrochloride
CID 119799547
N-cyclopentyl-N-[(2-methoxyphenyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 154909292
N-methyl-N-[1-(4-methylsulfinylphenyl)ethyl]morpholine-2-carboxamide
CID 119818195
N-benzyl-N-(2,2-difluoroethyl)morpholine-2-carboxamide;hydrochloride
CID 119807977

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride (CID 119799553) is N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride is CC(c1ccccc1)N(CC1CCC1)C(=O)C1CNCCO1.Cl.
What is the InChIKey of N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride?
The InChIKey is HPEOJUOXYFMYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2.ClH/c1-14(16-8-3-2-4-9-16)20(13-15-6-5-7-15)18(21)17-12-19-10-11-22-17;/h2-4,8-9,14-15,17,19H,5-7,10-13H2,1H3;1H.
What are the key properties of N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride?
N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride has a molecular weight of 338.88 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-(1-phenylethyl)morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119799553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).