5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride

C15H25Cl2N3O2 — CID 120642682

IUPAC5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride
SMILESCc1ccc(N)cc1C(=O)NC(C)CN1CCOCC1.Cl.Cl
InChIInChI=1S/C15H23N3O2.2ClH/c1-11-3-4-13(16)9-14(11)15(19)17-12(2)10-18-5-7-20-8-6-18;;/h3-4,9,12H,5-8,10,16H2,1-2H3,(H,17,19);2*1H
InChIKeyKYWGEIJJAYTPNP-UHFFFAOYSA-N
MW350.29 g/mol
LogP1.87
Rot. Bonds4

About 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride

5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride (PubChem CID 120642682) has the molecular formula C15H25Cl2N3O2 and a molecular weight of 350.29 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride
PubChem CID120642682
Molecular FormulaC15H25Cl2N3O2
Molecular Weight350.29 g/mol
Exact Mass349.13
IUPAC Name5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride
SMILESCc1ccc(N)cc1C(=O)NC(C)CN1CCOCC1.Cl.Cl
InChIInChI=1S/C15H23N3O2.2ClH/c1-11-3-4-13(16)9-14(11)15(19)17-12(2)10-18-5-7-20-8-6-18;;/h3-4,9,12H,5-8,10,16H2,1-2H3,(H,17,19);2*1H
InChIKeyKYWGEIJJAYTPNP-UHFFFAOYSA-N
XLogP1.87
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.29
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-methyl-N-(2-morpholin-4-ylpropyl)benzamide;dihydrochloride
CID 120642354
2-chloro-5-hydroxy-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 106501557
1,6-dimethyl-N-[(2S)-1-morpholin-4-ylpropan-2-yl]-4-oxopyridine-3-carboxamide
CID 126449276
5-amino-2-methyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 120640346
2-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)-5-sulfanylbenzamide
CID 107025186
4-amino-2-chloro-N-(1-piperidin-1-ylpropan-2-yl)benzamide;dihydrochloride
CID 119851476
4-carbamothioyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 61499910
3-carbamothioyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 61499952
1-ethyl-3-methyl-N-(1-morpholin-4-ylpropan-2-yl)pyrazole-4-carboxamide
CID 4772972
2,5-dichloro-N-(1-morpholin-4-ylpropan-2-yl)pyridine-4-carboxamide
CID 114917727
3-amino-2,6-difluoro-N-(1-morpholin-4-ylpropan-2-yl)benzamide
CID 79760388
6-cyclopropyl-2-methyl-N-[(2S)-1-morpholin-4-ylpropan-2-yl]pyridine-3-carboxamide
CID 125144229

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride?
The IUPAC name of 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride (CID 120642682) is 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride.
What is the SMILES notation for 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride?
The canonical SMILES for 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride is Cc1ccc(N)cc1C(=O)NC(C)CN1CCOCC1.Cl.Cl.
What is the InChIKey of 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride?
The InChIKey is KYWGEIJJAYTPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2.2ClH/c1-11-3-4-13(16)9-14(11)15(19)17-12(2)10-18-5-7-20-8-6-18;;/h3-4,9,12H,5-8,10,16H2,1-2H3,(H,17,19);2*1H.
What are the key properties of 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride?
5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride has a molecular weight of 350.29 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1-morpholin-4-ylpropan-2-yl)benzamide;dihydrochloride is sourced from PubChem (CID 120642682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).