N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide

C18H30N2O — CID 119599953

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide
SMILESCCC(CC(=O)NC(C)(CN)CC(C)C)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-5-15(16-9-7-6-8-10-16)11-17(21)20-18(4,13-19)12-14(2)3/h6-10,14-15H,5,11-13,19H2,1-4H3,(H,20,21)
InChIKeyIEGOEMVRPWFSKG-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.45
Rot. Bonds8

About N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide

N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide (PubChem CID 119599953) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide
PubChem CID119599953
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide
SMILESCCC(CC(=O)NC(C)(CN)CC(C)C)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-5-15(16-9-7-6-8-10-16)11-17(21)20-18(4,13-19)12-14(2)3/h6-10,14-15H,5,11-13,19H2,1-4H3,(H,20,21)
InChIKeyIEGOEMVRPWFSKG-UHFFFAOYSA-N
XLogP3.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpropanamide
CID 122080681
3-acetamido-N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpropanamide
CID 119598759
N-(1-amino-2,4-dimethylpentan-2-yl)-2-phenylbutanamide
CID 115309768
N-(1-amino-2,4-dimethylpentan-2-yl)-3-methylpentanamide
CID 114875694
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-methylphenyl)acetamide
CID 81424785
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-bromophenyl)acetamide
CID 119599373
N-(2-hydroxy-2,3-dimethylbutyl)-3-phenylpentanamide
CID 111484060
(2S)-2-(3-phenylpentanoylamino)propanoic acid
CID 119238309
(2R)-2-phenyl-2-(3-phenylpentanoylamino)acetic acid
CID 119368014
N-(1-amino-2,4-dimethylpentan-2-yl)-2-naphthalen-2-ylacetamide;hydrochloride
CID 119597467
2,2-dimethyl-5-phenylheptan-3-one
CID 15091945
N-(1-amino-2,4-dimethylpentan-2-yl)-2-methylbenzamide
CID 81487529

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide (CID 119599953) is N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide is CCC(CC(=O)NC(C)(CN)CC(C)C)c1ccccc1.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide?
The InChIKey is IEGOEMVRPWFSKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-5-15(16-9-7-6-8-10-16)11-17(21)20-18(4,13-19)12-14(2)3/h6-10,14-15H,5,11-13,19H2,1-4H3,(H,20,21).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide has a molecular weight of 290.45 g/mol, XLogP of 3.45, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-3-phenylpentanamide is sourced from PubChem (CID 119599953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).