(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide

C12H25N3O — CID 107569104

IUPAC(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
SMILESCCC[C@H](N)C(=O)NC1CCN(CC)CC1
InChIInChI=1S/C12H25N3O/c1-3-5-11(13)12(16)14-10-6-8-15(4-2)9-7-10/h10-11H,3-9,13H2,1-2H3,(H,14,16)/t11-/m0/s1
InChIKeySLVXPPQGIUUFKG-NSHDSACASA-N
MW227.35 g/mol
LogP0.71
Rot. Bonds5

About (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide

(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide (PubChem CID 107569104) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
PubChem CID107569104
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
SMILESCCC[C@H](N)C(=O)NC1CCN(CC)CC1
InChIInChI=1S/C12H25N3O/c1-3-5-11(13)12(16)14-10-6-8-15(4-2)9-7-10/h10-11H,3-9,13H2,1-2H3,(H,14,16)/t11-/m0/s1
InChIKeySLVXPPQGIUUFKG-NSHDSACASA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-(1-ethylpiperidin-4-yl)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

(2R)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
CID 103813279
ethyl 4-[[(2S)-2-aminopentanoyl]amino]piperidine-1-carboxylate
CID 93255529
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]pentanamide
CID 43711915
2-amino-N-(4-aminocyclohexyl)pentanamide
CID 62319442
2-amino-N-(1-cyclopropylsulfonylpiperidin-4-yl)pentanamide;hydrochloride
CID 119341231
2-amino-N-(4-propan-2-ylcyclohexyl)pentanamide
CID 119339852
2-amino-N-(1-ethylpiperidin-4-yl)-3-methylpentanamide
CID 54917233
(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide
CID 103814653
6-amino-N-(1-ethylpiperidin-4-yl)-2-methylheptanamide
CID 65292005
2-amino-N-(1-ethylpiperidin-4-yl)-3-phenylpropanamide
CID 61039141
(2S)-2-amino-N-(1-ethylpyrrolidin-3-yl)propanamide
CID 130979651
2-amino-N-(1-propylpiperidin-4-yl)butanediamide
CID 61275785

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide?
The IUPAC name of (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide (CID 107569104) is (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide is CCC[C@H](N)C(=O)NC1CCN(CC)CC1.
What is the InChIKey of (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide?
The InChIKey is SLVXPPQGIUUFKG-NSHDSACASA-N. The full InChI is InChI=1S/C12H25N3O/c1-3-5-11(13)12(16)14-10-6-8-15(4-2)9-7-10/h10-11H,3-9,13H2,1-2H3,(H,14,16)/t11-/m0/s1.
What are the key properties of (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide?
(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide has a molecular weight of 227.35 g/mol, XLogP of 0.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide is sourced from PubChem (CID 107569104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).