(2S)-2-piperidin-1-yl-N-propylpropanamide

C11H22N2O — CID 95274593

IUPAC(2S)-2-piperidin-1-yl-N-propylpropanamide
SMILESCCCNC(=O)[C@H](C)N1CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-7-12-11(14)10(2)13-8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1
InChIKeyVJQFCGONIRGRBN-JTQLQIEISA-N
MW198.31 g/mol
LogP1.39
Rot. Bonds4

About (2S)-2-piperidin-1-yl-N-propylpropanamide

(2S)-2-piperidin-1-yl-N-propylpropanamide (PubChem CID 95274593) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (2S)-2-piperidin-1-yl-N-propylpropanamide.

Molecular Properties

Compound Name(2S)-2-piperidin-1-yl-N-propylpropanamide
PubChem CID95274593
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(2S)-2-piperidin-1-yl-N-propylpropanamide
SMILESCCCNC(=O)[C@H](C)N1CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-7-12-11(14)10(2)13-8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1
InChIKeyVJQFCGONIRGRBN-JTQLQIEISA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-piperidin-1-yl-N-propylpropanamide 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

2-(azepan-1-yl)-N-[2-(ethylamino)ethyl]propanamide;dihydrochloride
CID 119505664
N-(2-aminoethyl)-2-(azepan-1-yl)propanamide;dihydrochloride
CID 119382789
2-piperidin-1-yl-N-prop-2-ynylpropanamide
CID 130156837
(2S)-2-(4-ethylsulfonylpiperazin-1-yl)-N-propylpropanamide
CID 94418958
2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]-N-propylpropanamide
CID 63847727
2-(azepan-1-yl)-N-[2-(methylamino)propyl]propanamide
CID 120829070
2-(4-hydroxyiminopiperidin-1-yl)-N-propylpropanamide
CID 43117218
1-(2-piperidin-1-ylpropyl)-3-propylurea
CID 115589371
N-(2-amino-2-ethylbutyl)-2-(azepan-1-yl)propanamide;dihydrochloride
CID 119640591
2-[1-[1-oxo-1-(propylamino)propan-2-yl]piperidin-4-yl]acetic acid
CID 79609150
2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-propylpropanamide
CID 62358014
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-propylpropanamide
CID 63849842

Frequently Asked Questions

What is the IUPAC name of (2S)-2-piperidin-1-yl-N-propylpropanamide?
The IUPAC name of (2S)-2-piperidin-1-yl-N-propylpropanamide (CID 95274593) is (2S)-2-piperidin-1-yl-N-propylpropanamide.
What is the SMILES notation for (2S)-2-piperidin-1-yl-N-propylpropanamide?
The canonical SMILES for (2S)-2-piperidin-1-yl-N-propylpropanamide is CCCNC(=O)[C@H](C)N1CCCCC1.
What is the InChIKey of (2S)-2-piperidin-1-yl-N-propylpropanamide?
The InChIKey is VJQFCGONIRGRBN-JTQLQIEISA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-7-12-11(14)10(2)13-8-5-4-6-9-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1.
What are the key properties of (2S)-2-piperidin-1-yl-N-propylpropanamide?
(2S)-2-piperidin-1-yl-N-propylpropanamide has a molecular weight of 198.31 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-piperidin-1-yl-N-propylpropanamide is sourced from PubChem (CID 95274593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).