N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride

C19H30ClN3O2 — CID 119721489

IUPACN-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N1CCC(NC(=O)c2ccccc2C)CC1.Cl
InChIInChI=1S/C19H29N3O2.ClH/c1-4-11-19(3,20)18(24)22-12-9-15(10-13-22)21-17(23)16-8-6-5-7-14(16)2;/h5-8,15H,4,9-13,20H2,1-3H3,(H,21,23);1H
InChIKeyRWEBMRYNJLFAJK-UHFFFAOYSA-N
MW367.92 g/mol
LogP2.66
Rot. Bonds5

About N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride

N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride (PubChem CID 119721489) has the molecular formula C19H30ClN3O2 and a molecular weight of 367.92 g/mol. Its IUPAC name is N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride
PubChem CID119721489
Molecular FormulaC19H30ClN3O2
Molecular Weight367.92 g/mol
Exact Mass367.20
IUPAC NameN-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride
SMILESCCCC(C)(N)C(=O)N1CCC(NC(=O)c2ccccc2C)CC1.Cl
InChIInChI=1S/C19H29N3O2.ClH/c1-4-11-19(3,20)18(24)22-12-9-15(10-13-22)21-17(23)16-8-6-5-7-14(16)2;/h5-8,15H,4,9-13,20H2,1-3H3,(H,21,23);1H
InChIKeyRWEBMRYNJLFAJK-UHFFFAOYSA-N
XLogP2.66
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.92
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-N-[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]benzamide
CID 108557648
N-[1-(2-aminopentanoyl)piperidin-4-yl]-2-methylbenzamide
CID 119288350
N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]thiophene-3-carboxamide
CID 119752077
N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
N,N-dimethyl-4-[(2-methylbenzoyl)amino]piperidine-1-carboxamide
CID 108562715
N-cyclopentyl-4-[(2-methylbenzoyl)amino]piperidine-1-carboxamide
CID 110822504
N-[1-[(2S)-2-amino-4-methylpentanoyl]piperidin-4-yl]-2-methylbenzamide;hydrochloride
CID 119721491
N-[1-(2-amino-3-methoxypropanoyl)piperidin-4-yl]-2-methylbenzamide
CID 120985992
N-[1-[2-(4-fluorophenoxy)-2-methylpropanoyl]piperidin-4-yl]-2-methylbenzamide
CID 39511425
N-[1-(3-amino-3-phenylpropanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride
CID 119949813
N-(1-cyclopropylpiperidin-4-yl)-2-methylbenzamide
CID 39974888
2,3,4-trifluoro-N-[1-(2-methylbenzoyl)piperidin-4-yl]benzamide
CID 108556830

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride?
The IUPAC name of N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride (CID 119721489) is N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride.
What is the SMILES notation for N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride?
The canonical SMILES for N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride is CCCC(C)(N)C(=O)N1CCC(NC(=O)c2ccccc2C)CC1.Cl.
What is the InChIKey of N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride?
The InChIKey is RWEBMRYNJLFAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O2.ClH/c1-4-11-19(3,20)18(24)22-12-9-15(10-13-22)21-17(23)16-8-6-5-7-14(16)2;/h5-8,15H,4,9-13,20H2,1-3H3,(H,21,23);1H.
What are the key properties of N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride?
N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride has a molecular weight of 367.92 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-amino-2-methylpentanoyl)piperidin-4-yl]-2-methylbenzamide;hydrochloride is sourced from PubChem (CID 119721489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).