N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide

C16H26N2O — CID 119522094

IUPACN-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide
SMILESCc1ccc(CCCCC(=O)NC(C)(C)CN)cc1
InChIInChI=1S/C16H26N2O/c1-13-8-10-14(11-9-13)6-4-5-7-15(19)18-16(2,3)12-17/h8-11H,4-7,12,17H2,1-3H3,(H,18,19)
InChIKeyGQNIQGAQBXMAMY-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.56
Rot. Bonds7

About N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide

N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide (PubChem CID 119522094) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide
PubChem CID119522094
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide
SMILESCc1ccc(CCCCC(=O)NC(C)(C)CN)cc1
InChIInChI=1S/C16H26N2O/c1-13-8-10-14(11-9-13)6-4-5-7-15(19)18-16(2,3)12-17/h8-11H,4-7,12,17H2,1-3H3,(H,18,19)
InChIKeyGQNIQGAQBXMAMY-UHFFFAOYSA-N
XLogP2.56
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide 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

N-(1-amino-2-cyclopropylpropan-2-yl)-5-(4-methylphenyl)pentanamide;hydrochloride
CID 119572987
N-(1-amino-2-methylpropan-2-yl)-3-(4-tert-butylphenyl)propanamide
CID 119522264
N-(1-amino-2-methylpropan-2-yl)-4-[4-(2-methoxyethyl)phenoxy]butanamide
CID 119522166
N-(2-amino-2-oxoethyl)-5-(4-methylphenyl)pentanamide
CID 56784821
N-(2,2-dimethylpropyl)-4-(4-methylphenyl)butanamide
CID 177221343
methyl (2S)-2-[5-(4-methylphenyl)pentanoylamino]propanoate
CID 86865868
N-(1-amino-2-methylpropan-2-yl)-3-[4-(difluoromethoxy)phenyl]propanamide
CID 119523960
10-(4-methylphenyl)decanoic acid
CID 54262490
N-(1-amino-2-methylpropan-2-yl)-3-(3,4-dimethoxyphenyl)propanamide
CID 82354510
6-(4-methylphenyl)hexanethioic S-acid
CID 177221439
5-(4-methylphenyl)pentanoyl 5-(4-methylphenyl)pentanoate
CID 91119269
[5-[(1-amino-2-methylpropan-2-yl)amino]-5-oxopentyl] hypoiodite
CID 146357651

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide (CID 119522094) is N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide is Cc1ccc(CCCCC(=O)NC(C)(C)CN)cc1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide?
The InChIKey is GQNIQGAQBXMAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-13-8-10-14(11-9-13)6-4-5-7-15(19)18-16(2,3)12-17/h8-11H,4-7,12,17H2,1-3H3,(H,18,19).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide?
N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide has a molecular weight of 262.40 g/mol, XLogP of 2.56, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-5-(4-methylphenyl)pentanamide is sourced from PubChem (CID 119522094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).