N-(4-phenylbutan-2-yl)morpholine-4-carboxamide

C15H22N2O2 — CID 2915222

IUPACN-(4-phenylbutan-2-yl)morpholine-4-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H22N2O2/c1-13(7-8-14-5-3-2-4-6-14)16-15(18)17-9-11-19-12-10-17/h2-6,13H,7-12H2,1H3,(H,16,18)
InChIKeyBSZMROMTNPYXEK-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.05
Rot. Bonds4

About N-(4-phenylbutan-2-yl)morpholine-4-carboxamide

N-(4-phenylbutan-2-yl)morpholine-4-carboxamide (PubChem CID 2915222) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(4-phenylbutan-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-phenylbutan-2-yl)morpholine-4-carboxamide
PubChem CID2915222
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(4-phenylbutan-2-yl)morpholine-4-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H22N2O2/c1-13(7-8-14-5-3-2-4-6-14)16-15(18)17-9-11-19-12-10-17/h2-6,13H,7-12H2,1H3,(H,16,18)
InChIKeyBSZMROMTNPYXEK-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-phenethylmorpholine-4-carbothioamide
CID 2725328
N-benzyl-N-methylmorpholine-4-carboxamide
CID 669645
N-benzylmorpholine-4-carboxamide
CID 760018
N-(3-phenylpropyl)morpholine-4-carboxamide
CID 1973120
N-(diphenylmethyl)morpholin-4-ylcarboxamide
CID 1538456
ethyl N-({3-[methyl(2-phenylethyl)amino]piperidin-1-yl}carbonyl)glycinate
CID 23723929
Morpholine-4-carboxylic acid [1-(1-cyano-3-phenyl-propylcarbamoyl)-3-methyl-butyl]-amide
CID 9843168
(S)-2-(N-(Morpholinocarbonyl)leucyl)amino-4-phenylbutanal
CID 10340297
Morpholine-4-carboxylic acid [1-(1-cyano-3-phenyl-propylcarbamoyl)-pentyl]-amide
CID 10960024
Morpholine-4-carboxylic acid {1-[(benzyl-cyano-methyl)-carbamoyl]-3-methyl-butyl}-amide
CID 11810830
1-Butan-2-yl-3-(3-phenylpropyl)urea
CID 45366530
1-[(2S)-butan-2-yl]-3-(3-phenylpropyl)urea
CID 93534208

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylbutan-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-(4-phenylbutan-2-yl)morpholine-4-carboxamide (CID 2915222) is N-(4-phenylbutan-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-phenylbutan-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-phenylbutan-2-yl)morpholine-4-carboxamide is CC(CCc1ccccc1)NC(=O)N1CCOCC1.
What is the InChIKey of N-(4-phenylbutan-2-yl)morpholine-4-carboxamide?
The InChIKey is BSZMROMTNPYXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-13(7-8-14-5-3-2-4-6-14)16-15(18)17-9-11-19-12-10-17/h2-6,13H,7-12H2,1H3,(H,16,18).
What are the key properties of N-(4-phenylbutan-2-yl)morpholine-4-carboxamide?
N-(4-phenylbutan-2-yl)morpholine-4-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylbutan-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 2915222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).