N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide

C18H21N3O4 — CID 94816221

IUPACN-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCN1CCO[C@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)C1
InChIInChI=1S/C18H21N3O4/c1-21-7-9-24-15(12-21)11-19-17(22)13-4-2-5-14(10-13)20-18(23)16-6-3-8-25-16/h2-6,8,10,15H,7,9,11-12H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeySNBWJGDOAKDHIZ-OAHLLOKOSA-N
MW343.38 g/mol
LogP1.59
Rot. Bonds5

About N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide

N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide (PubChem CID 94816221) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide
PubChem CID94816221
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide
SMILESCN1CCO[C@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)C1
InChIInChI=1S/C18H21N3O4/c1-21-7-9-24-15(12-21)11-19-17(22)13-4-2-5-14(10-13)20-18(23)16-6-3-8-25-16/h2-6,8,10,15H,7,9,11-12H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1
InChIKeySNBWJGDOAKDHIZ-OAHLLOKOSA-N
XLogP1.59
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(chloromethyl)-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 79082923
N-[3-[4-(4-methylpiperidin-1-yl)butylcarbamoyl]phenyl]furan-2-carboxamide
CID 55847878
N-[(4-benzylmorpholin-2-yl)methyl]-3-(2,2-dimethylpropanoylamino)benzamide
CID 134057540
5-[(4-methylmorpholin-2-yl)methylcarbamoyl]furan-3-carboxylic acid
CID 113432368
tert-butyl N-[3-[2-[[(2R)-4-methylmorpholin-2-yl]methylamino]-2-oxoethyl]phenyl]carbamate
CID 97255978
N-[3-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]carbamoyl]phenyl]furan-2-carboxamide
CID 55843395
4-methyl-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 49094811
N-[(4-methylmorpholin-2-yl)methyl]-2-phenylacetamide
CID 110710224
N-[3-(2-hydroxypropylcarbamoyl)phenyl]furan-2-carboxamide
CID 78897732
4-bromo-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 49094765
4-chloro-N-[(4-methylmorpholin-2-yl)methyl]benzamide
CID 49094780
N-[3-[(3-acetamidophenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 27244358

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide (CID 94816221) is N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide is CN1CCO[C@H](CNC(=O)c2cccc(NC(=O)c3ccco3)c2)C1.
What is the InChIKey of N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide?
The InChIKey is SNBWJGDOAKDHIZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-21-7-9-24-15(12-21)11-19-17(22)13-4-2-5-14(10-13)20-18(23)16-6-3-8-25-16/h2-6,8,10,15H,7,9,11-12H2,1H3,(H,19,22)(H,20,23)/t15-/m1/s1.
What are the key properties of N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide?
N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(2R)-4-methylmorpholin-2-yl]methylcarbamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 94816221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).