N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide

C16H24N2O2 — CID 119782789

IUPACN-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide
SMILESCc1ccccc1C(NC(=O)C1CNCCO1)C(C)C
InChIInChI=1S/C16H24N2O2/c1-11(2)15(13-7-5-4-6-12(13)3)18-16(19)14-10-17-8-9-20-14/h4-7,11,14-15,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyZQNSQDMMPCVPCM-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.80
Rot. Bonds4

About N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide

N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide (PubChem CID 119782789) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide
PubChem CID119782789
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide
SMILESCc1ccccc1C(NC(=O)C1CNCCO1)C(C)C
InChIInChI=1S/C16H24N2O2/c1-11(2)15(13-7-5-4-6-12(13)3)18-16(19)14-10-17-8-9-20-14/h4-7,11,14-15,17H,8-10H2,1-3H3,(H,18,19)
InChIKeyZQNSQDMMPCVPCM-UHFFFAOYSA-N
XLogP1.80
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methylphenyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119686063
N-[(1S)-1-naphthalen-1-ylethyl]morpholine-2-carboxamide
CID 146426620
N-[1-(2-methoxyphenyl)-3-methylbutyl]morpholine-2-carboxamide
CID 119816799
N-[(1S)-1-(furan-2-yl)ethyl]morpholine-2-carboxamide
CID 81400797
N-[1-(2-ethoxyphenyl)-3-methylbutyl]morpholine-2-carboxamide
CID 119812339
N-[(1R)-1-pyridin-2-ylethyl]morpholine-2-carboxamide
CID 81407111
N-[(1R)-1-thiophen-2-ylethyl]morpholine-2-carboxamide
CID 81408817
N-[1-(2-ethoxyphenyl)propyl]morpholine-2-carboxamide
CID 119721402
N-[(1S)-3-methyl-1-(2-methylphenyl)butyl]-2-[(2S)-morpholin-2-yl]acetamide
CID 129393193
(2-methylphenyl)-morpholin-2-ylmethanone
CID 84673271
N-[1-(2,4-difluorophenyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119686288
N-[(2R)-1-amino-1-oxopropan-2-yl]morpholine-2-carboxamide
CID 130549246

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide?
The IUPAC name of N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide (CID 119782789) is N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide?
The canonical SMILES for N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide is Cc1ccccc1C(NC(=O)C1CNCCO1)C(C)C.
What is the InChIKey of N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide?
The InChIKey is ZQNSQDMMPCVPCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)15(13-7-5-4-6-12(13)3)18-16(19)14-10-17-8-9-20-14/h4-7,11,14-15,17H,8-10H2,1-3H3,(H,18,19).
What are the key properties of N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide?
N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-(2-methylphenyl)propyl]morpholine-2-carboxamide is sourced from PubChem (CID 119782789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).