5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride

C19H25ClN2O — CID 120630670

IUPAC5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride
SMILESCc1ccc(N)cc1C(=O)NCCCCCc1ccccc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-15-11-12-17(20)14-18(15)19(22)21-13-7-3-6-10-16-8-4-2-5-9-16;/h2,4-5,8-9,11-12,14H,3,6-7,10,13,20H2,1H3,(H,21,22);1H
InChIKeySHLBEQDDUQORRF-UHFFFAOYSA-N
MW332.88 g/mol
LogP4.14
Rot. Bonds7

About 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride

5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride (PubChem CID 120630670) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride.

Molecular Properties

Compound Name5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride
PubChem CID120630670
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC Name5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride
SMILESCc1ccc(N)cc1C(=O)NCCCCCc1ccccc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-15-11-12-17(20)14-18(15)19(22)21-13-7-3-6-10-16-8-4-2-5-9-16;/h2,4-5,8-9,11-12,14H,3,6-7,10,13,20H2,1H3,(H,21,22);1H
InChIKeySHLBEQDDUQORRF-UHFFFAOYSA-N
XLogP4.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 2202785
5-amino-2-methyl-N-[4-(N-methylanilino)butyl]benzamide
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CID 120617889
3-amino-N-(4-phenylbutyl)benzamide;hydrochloride
CID 19353694
methyl 7-[(5-amino-2-methylbenzoyl)amino]heptanoate
CID 120619661
8-phenyloctylcarbamic acid
CID 90271205
5-amino-2-methyl-N-[4-(4-methylphenoxy)butyl]benzamide;hydrochloride
CID 120622289
5-amino-2-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 61290785
5-amino-N-[2-[3-(dimethylcarbamoyl)phenyl]ethyl]-2-methylbenzamide;hydrochloride
CID 120635957
5-amino-2,4-dimethyl-N-(2-phenylethyl)benzamide
CID 102704827
5-amino-N-(3-amino-3-oxopropyl)-2-methylbenzamide
CID 91141603
4-amino-N-(3-phenylpropyl)benzamide
CID 10658614

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride?
The IUPAC name of 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride (CID 120630670) is 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride.
What is the SMILES notation for 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride?
The canonical SMILES for 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride is Cc1ccc(N)cc1C(=O)NCCCCCc1ccccc1.Cl.
What is the InChIKey of 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride?
The InChIKey is SHLBEQDDUQORRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O.ClH/c1-15-11-12-17(20)14-18(15)19(22)21-13-7-3-6-10-16-8-4-2-5-9-16;/h2,4-5,8-9,11-12,14H,3,6-7,10,13,20H2,1H3,(H,21,22);1H.
What are the key properties of 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride?
5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 4.14, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(5-phenylpentyl)benzamide;hydrochloride is sourced from PubChem (CID 120630670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).