N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide

C15H22N2O3 — CID 119707515

IUPACN-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide
SMILESCC(C)Oc1ccccc1CNC(=O)C1COCCN1
InChIInChI=1S/C15H22N2O3/c1-11(2)20-14-6-4-3-5-12(14)9-17-15(18)13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3,(H,17,18)
InChIKeyHBUBKWWHQYWTLH-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.08
Rot. Bonds5

About N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide

N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide (PubChem CID 119707515) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide
PubChem CID119707515
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide
SMILESCC(C)Oc1ccccc1CNC(=O)C1COCCN1
InChIInChI=1S/C15H22N2O3/c1-11(2)20-14-6-4-3-5-12(14)9-17-15(18)13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3,(H,17,18)
InChIKeyHBUBKWWHQYWTLH-UHFFFAOYSA-N
XLogP1.08
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-[[2-(3-methylbutoxy)phenyl]methyl]morpholine-3-carboxamide
CID 124682602
N-[(2-propan-2-yloxyphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119280684
2-[2-[(morpholine-3-carbonylamino)methyl]phenyl]acetic acid
CID 81317493
N-[[2-(3-methylphenoxy)phenyl]methyl]morpholine-3-carboxamide
CID 119777833
N-[(2,3-dimethoxyphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119708865
N-[[2-(difluoromethoxy)-3-ethoxyphenyl]methyl]morpholine-3-carboxamide
CID 119816482
N-[[2-(difluoromethoxy)-3-ethoxyphenyl]methyl]morpholine-3-carboxamide;hydrochloride
CID 119816481
N-[2-(2-fluorophenoxy)propyl]morpholine-3-carboxamide
CID 119804849
N-[(2-propan-2-yloxyphenyl)methyl]morpholine-2-carboxamide;hydrochloride
CID 119707554
N-[(2-morpholin-4-ylphenyl)methyl]morpholine-3-carboxamide
CID 119853743
N-[(2-methoxynaphthalen-1-yl)methyl]morpholine-3-carboxamide;hydrochloride
CID 119709351
N-[2-(2-fluorophenoxy)butyl]morpholine-3-carboxamide
CID 119813317

Frequently Asked Questions

What is the IUPAC name of N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide?
The IUPAC name of N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide (CID 119707515) is N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide?
The canonical SMILES for N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide is CC(C)Oc1ccccc1CNC(=O)C1COCCN1.
What is the InChIKey of N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide?
The InChIKey is HBUBKWWHQYWTLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-11(2)20-14-6-4-3-5-12(14)9-17-15(18)13-10-19-8-7-16-13/h3-6,11,13,16H,7-10H2,1-2H3,(H,17,18).
What are the key properties of N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide?
N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide has a molecular weight of 278.35 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-propan-2-yloxyphenyl)methyl]morpholine-3-carboxamide is sourced from PubChem (CID 119707515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).