4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide

C23H28N2O3 — CID 129168486

IUPAC4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide
SMILESC[C@@]1(Cc2ccc(NC(=O)c3ccc(OCC4CC4)cc3)cc2)CNCCO1
InChIInChI=1S/C23H28N2O3/c1-23(16-24-12-13-28-23)14-17-4-8-20(9-5-17)25-22(26)19-6-10-21(11-7-19)27-15-18-2-3-18/h4-11,18,24H,2-3,12-16H2,1H3,(H,25,26)/t23-/m1/s1
InChIKeyMAESMTIKCWDBGF-HSZRJFAPSA-N
MW380.49 g/mol
LogP3.65
Rot. Bonds7

About 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide

4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide (PubChem CID 129168486) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide.

Molecular Properties

Compound Name4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide
PubChem CID129168486
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide
SMILESC[C@@]1(Cc2ccc(NC(=O)c3ccc(OCC4CC4)cc3)cc2)CNCCO1
InChIInChI=1S/C23H28N2O3/c1-23(16-24-12-13-28-23)14-17-4-8-20(9-5-17)25-22(26)19-6-10-21(11-7-19)27-15-18-2-3-18/h4-11,18,24H,2-3,12-16H2,1H3,(H,25,26)/t23-/m1/s1
InChIKeyMAESMTIKCWDBGF-HSZRJFAPSA-N
XLogP3.65
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide with MolForge

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Related Compounds

4-(aminomethyl)-N-[4-(cyclopropylmethoxy)phenyl]benzamide
CID 119325256
4-[[4-(cyclopropylmethoxy)benzoyl]amino]benzamide
CID 60571619
4-[(carbamoylamino)methyl]-N-[4-(cyclopropylmethoxy)phenyl]benzamide
CID 75371278
4-(cyclopropylmethoxy)-N-[4-[3-(dimethylamino)propoxy]phenyl]benzamide
CID 86898305
4-(cyclopropylmethoxy)-N-[6-(hydroxymethyl)naphthalen-2-yl]benzamide
CID 58111737
N-(4-acetamidophenyl)-4-[[(2R)-oxolan-2-yl]methoxy]benzamide
CID 40642293
N-[4-[[(2S)-oxiran-2-yl]methoxy]phenyl]acetamide
CID 737230
4-(cyclopropylmethoxy)-N-[4-(dimethylamino)-3-methylphenyl]benzamide
CID 60571631
N-[4-[[(3R)-pyrrolidin-3-yl]methoxy]phenyl]acetamide
CID 86321304
methyl 4-[2-[4-[[2-amino-5-(cyclopropylmethoxy)benzoyl]amino]phenyl]ethyl]benzoate
CID 118863680
4-(cyclopropylmethoxy)-N-[4-[(1S,3R,4S)-2-oxa-5-azabicyclo[2.2.1]heptan-3-yl]phenyl]benzamide
CID 118695720
4-methyl-N-[4-(oxolan-2-ylmethoxy)phenyl]benzamide
CID 4957909

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide?
The IUPAC name of 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide (CID 129168486) is 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide.
What is the SMILES notation for 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide?
The canonical SMILES for 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide is C[C@@]1(Cc2ccc(NC(=O)c3ccc(OCC4CC4)cc3)cc2)CNCCO1.
What is the InChIKey of 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide?
The InChIKey is MAESMTIKCWDBGF-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-23(16-24-12-13-28-23)14-17-4-8-20(9-5-17)25-22(26)19-6-10-21(11-7-19)27-15-18-2-3-18/h4-11,18,24H,2-3,12-16H2,1H3,(H,25,26)/t23-/m1/s1.
What are the key properties of 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide?
4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide has a molecular weight of 380.49 g/mol, XLogP of 3.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylmethoxy)-N-[4-[[(2R)-2-methylmorpholin-2-yl]methyl]phenyl]benzamide is sourced from PubChem (CID 129168486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).