(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide

C12H25N3O — CID 103814653

IUPAC(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide
SMILESCCC[C@@H](N)C(=O)NC1CCN(C)C(C)C1
InChIInChI=1S/C12H25N3O/c1-4-5-11(13)12(16)14-10-6-7-15(3)9(2)8-10/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t9?,10?,11-/m1/s1
InChIKeyBFDMCUGFKJVUTR-VQXHTEKXSA-N
MW227.35 g/mol
LogP0.71
Rot. Bonds4

About (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide

(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide (PubChem CID 103814653) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide
PubChem CID103814653
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide
SMILESCCC[C@@H](N)C(=O)NC1CCN(C)C(C)C1
InChIInChI=1S/C12H25N3O/c1-4-5-11(13)12(16)14-10-6-7-15(3)9(2)8-10/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t9?,10?,11-/m1/s1
InChIKeyBFDMCUGFKJVUTR-VQXHTEKXSA-N
XLogP0.71
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

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Related Compounds

(2S)-2-[(1,2-dimethylpiperidin-4-yl)carbamoylamino]pentanoic acid
CID 107567367
(2R)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
CID 103813279
cis-(1R,3S)-3-[[(2R)-2-aminopentanoyl]amino]cyclopentane-1-carboxylic acid
CID 106322988
(2S)-2-amino-N-(1-ethylpiperidin-4-yl)pentanamide
CID 107569104
3-(2-aminopentanoylamino)cyclopentane-1-carboxylic acid
CID 66031566
ethyl 4-[[(2S)-2-aminopentanoyl]amino]piperidine-1-carboxylate
CID 93255529
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]pentanamide
CID 43711915
3-(2-aminopentanoylamino)cyclohexane-1-carboxamide
CID 119309150
2-amino-N-(1-cyclopropylsulfonylpiperidin-4-yl)pentanamide;hydrochloride
CID 119341231
2-amino-N-(4-aminocyclohexyl)pentanamide
CID 62319442
2-amino-N-(3-ethylcyclohexyl)pentanamide;hydrochloride
CID 119329059
2-amino-N-(4-propan-2-ylcyclohexyl)pentanamide
CID 119339852

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide (CID 103814653) is (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide is CCC[C@@H](N)C(=O)NC1CCN(C)C(C)C1.
What is the InChIKey of (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide?
The InChIKey is BFDMCUGFKJVUTR-VQXHTEKXSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-5-11(13)12(16)14-10-6-7-15(3)9(2)8-10/h9-11H,4-8,13H2,1-3H3,(H,14,16)/t9?,10?,11-/m1/s1.
What are the key properties of (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide?
(2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide has a molecular weight of 227.35 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1,2-dimethylpiperidin-4-yl)pentanamide is sourced from PubChem (CID 103814653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).