(2S)-N-cyclopentyl-2-(methylamino)propanamide

C9H18N2O — CID 28827015

IUPAC(2S)-N-cyclopentyl-2-(methylamino)propanamide
SMILESCN[C@@H](C)C(=O)NC1CCCC1
InChIInChI=1S/C9H18N2O/c1-7(10-2)9(12)11-8-5-3-4-6-8/h7-8,10H,3-6H2,1-2H3,(H,11,12)/t7-/m0/s1
InChIKeyOAUVUTNSSAEQFT-ZETCQYMHSA-N
MW170.26 g/mol
LogP0.65
Rot. Bonds3

About (2S)-N-cyclopentyl-2-(methylamino)propanamide

(2S)-N-cyclopentyl-2-(methylamino)propanamide (PubChem CID 28827015) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-2-(methylamino)propanamide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-2-(methylamino)propanamide
PubChem CID28827015
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name(2S)-N-cyclopentyl-2-(methylamino)propanamide
SMILESCN[C@@H](C)C(=O)NC1CCCC1
InChIInChI=1S/C9H18N2O/c1-7(10-2)9(12)11-8-5-3-4-6-8/h7-8,10H,3-6H2,1-2H3,(H,11,12)/t7-/m0/s1
InChIKeyOAUVUTNSSAEQFT-ZETCQYMHSA-N
XLogP0.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-(methylamino)propanamide
CID 43083499
(2S)-N-cyclobutyl-2-(methylamino)propanamide
CID 90052671
N-cyclohexyl-2-(cyclooctylamino)propanamide
CID 43083622
2-(cycloheptylamino)-N-cyclohexylpropanamide
CID 43236394
N-cyclopentyl-2-(cyclopropylamino)propanamide
CID 43083564
2-(cyclohexylamino)-N-cyclopentylpropanamide
CID 43083335
N-(1-acetylpiperidin-4-yl)-2-(methylamino)propanamide
CID 62639484
N-(1,1-dioxothian-3-yl)-2-(methylamino)propanamide
CID 63924115
N-cyclopentyl-2-(cyclopropylcarbamoylamino)propanamide
CID 47076626
N-cyclohexyl-2-[[(1S)-1-cyclohexylethyl]amino]propanamide
CID 81384329
N-cyclohexyl-2-[[(1R)-1-cyclohexylethyl]amino]propanamide
CID 81384882
N-cyclopentyl-2-(3,3-dimethylbutan-2-ylamino)propanamide
CID 113457776

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-2-(methylamino)propanamide?
The IUPAC name of (2S)-N-cyclopentyl-2-(methylamino)propanamide (CID 28827015) is (2S)-N-cyclopentyl-2-(methylamino)propanamide.
What is the SMILES notation for (2S)-N-cyclopentyl-2-(methylamino)propanamide?
The canonical SMILES for (2S)-N-cyclopentyl-2-(methylamino)propanamide is CN[C@@H](C)C(=O)NC1CCCC1.
What is the InChIKey of (2S)-N-cyclopentyl-2-(methylamino)propanamide?
The InChIKey is OAUVUTNSSAEQFT-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H18N2O/c1-7(10-2)9(12)11-8-5-3-4-6-8/h7-8,10H,3-6H2,1-2H3,(H,11,12)/t7-/m0/s1.
What are the key properties of (2S)-N-cyclopentyl-2-(methylamino)propanamide?
(2S)-N-cyclopentyl-2-(methylamino)propanamide has a molecular weight of 170.26 g/mol, XLogP of 0.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-2-(methylamino)propanamide is sourced from PubChem (CID 28827015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).