N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide

C18H25N3O2 — CID 9361250

IUPACN-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide
SMILESC[C@H](Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CCCCC1
InChIInChI=1S/C18H25N3O2/c1-13(18(23)21-10-3-2-4-11-21)19-16-7-5-6-14(12-16)17(22)20-15-8-9-15/h5-7,12-13,15,19H,2-4,8-11H2,1H3,(H,20,22)/t13-/m0/s1
InChIKeyIZXZMMFWJFVXKZ-ZDUSSCGKSA-N
MW315.42 g/mol
LogP2.39
Rot. Bonds5

About N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide

N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide (PubChem CID 9361250) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide
PubChem CID9361250
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC NameN-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide
SMILESC[C@H](Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CCCCC1
InChIInChI=1S/C18H25N3O2/c1-13(18(23)21-10-3-2-4-11-21)19-16-7-5-6-14(12-16)17(22)20-15-8-9-15/h5-7,12-13,15,19H,2-4,8-11H2,1H3,(H,20,22)/t13-/m0/s1
InChIKeyIZXZMMFWJFVXKZ-ZDUSSCGKSA-N
XLogP2.39
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide with MolForge

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Related Compounds

3-[(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)amino]benzamide
CID 18086394
3-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]benzamide
CID 103600833
2-(3-methoxyanilino)-1-piperidin-1-ylpropan-1-one
CID 43083385
3-(1-aminopropan-2-ylamino)-N-cyclopropylbenzamide
CID 103387471
1-N,3-N-bis[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzene-1,3-dicarboxamide
CID 11090985
2-(3-ethylanilino)-1-pyrrolidin-1-ylpropan-1-one
CID 43083698
N-cycloheptyl-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051684
3-acetamido-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]benzamide
CID 108553808
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
2-(3-nitroanilino)-1-pyrrolidin-1-ylpropan-1-one
CID 112683085
N-cyclohexyl-3-(methoxyamino)benzamide
CID 142229646
3-[[(2S)-2-aminopropanoyl]amino]-N-cyclopropylbenzamide
CID 78969031

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide?
The IUPAC name of N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide (CID 9361250) is N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide is C[C@H](Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CCCCC1.
What is the InChIKey of N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide?
The InChIKey is IZXZMMFWJFVXKZ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-13(18(23)21-10-3-2-4-11-21)19-16-7-5-6-14(12-16)17(22)20-15-8-9-15/h5-7,12-13,15,19H,2-4,8-11H2,1H3,(H,20,22)/t13-/m0/s1.
What are the key properties of N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide?
N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide has a molecular weight of 315.42 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]amino]benzamide is sourced from PubChem (CID 9361250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).