(2S)-2-amino-N-decyl-2-phenylacetamide

C18H30N2O — CID 104898142

IUPAC(2S)-2-amino-N-decyl-2-phenylacetamide
SMILESCCCCCCCCCCNC(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-2-3-4-5-6-7-8-12-15-20-18(21)17(19)16-13-10-9-11-14-16/h9-11,13-14,17H,2-8,12,15,19H2,1H3,(H,20,21)/t17-/m0/s1
InChIKeyPNBYTBHQMVHHQX-KRWDZBQOSA-N
MW290.45 g/mol
LogP3.94
Rot. Bonds11

About (2S)-2-amino-N-decyl-2-phenylacetamide

(2S)-2-amino-N-decyl-2-phenylacetamide (PubChem CID 104898142) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is (2S)-2-amino-N-decyl-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-amino-N-decyl-2-phenylacetamide
PubChem CID104898142
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name(2S)-2-amino-N-decyl-2-phenylacetamide
SMILESCCCCCCCCCCNC(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C18H30N2O/c1-2-3-4-5-6-7-8-12-15-20-18(21)17(19)16-13-10-9-11-14-16/h9-11,13-14,17H,2-8,12,15,19H2,1H3,(H,20,21)/t17-/m0/s1
InChIKeyPNBYTBHQMVHHQX-KRWDZBQOSA-N
XLogP3.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(5-hydroxypentyl)-2-phenylacetamide
CID 69266542
(2S)-2-amino-N-(7-methyloctyl)-2-phenylacetamide
CID 104897653
N-dodecyl-2,2-diphenylacetamide
CID 5143289
N,N'-dihexyl-2-phenylpropanediamide
CID 3396321
(2R)-2-amino-N-(5-methylsulfanylpentyl)-2-phenylacetamide
CID 114127295
2-amino-N-(3-formamidopropyl)-2-phenylacetamide
CID 110463054
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
2-amino-N-[4-(dimethylamino)butyl]-2-phenylacetamide;dihydrochloride
CID 119852800
(2S)-2-amino-N-octan-2-yl-2-phenylacetamide
CID 104897331
2-amino-N-(3-methoxypropyl)-2-phenylacetamide;hydrochloride
CID 119262550
2-amino-N-(3-methylsulfanylpropyl)-2-phenylacetamide
CID 63960595
2-amino-N-decyl-3-phenylpropanamide
CID 122423651

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-decyl-2-phenylacetamide?
The IUPAC name of (2S)-2-amino-N-decyl-2-phenylacetamide (CID 104898142) is (2S)-2-amino-N-decyl-2-phenylacetamide.
What is the SMILES notation for (2S)-2-amino-N-decyl-2-phenylacetamide?
The canonical SMILES for (2S)-2-amino-N-decyl-2-phenylacetamide is CCCCCCCCCCNC(=O)[C@@H](N)c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-decyl-2-phenylacetamide?
The InChIKey is PNBYTBHQMVHHQX-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H30N2O/c1-2-3-4-5-6-7-8-12-15-20-18(21)17(19)16-13-10-9-11-14-16/h9-11,13-14,17H,2-8,12,15,19H2,1H3,(H,20,21)/t17-/m0/s1.
What are the key properties of (2S)-2-amino-N-decyl-2-phenylacetamide?
(2S)-2-amino-N-decyl-2-phenylacetamide has a molecular weight of 290.45 g/mol, XLogP of 3.94, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-decyl-2-phenylacetamide is sourced from PubChem (CID 104898142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).