3-methyl-N-(piperidin-2-ylmethyl)pentanamide

C12H24N2O — CID 114874123

IUPAC3-methyl-N-(piperidin-2-ylmethyl)pentanamide
SMILESCCC(C)CC(=O)NCC1CCCCN1
InChIInChI=1S/C12H24N2O/c1-3-10(2)8-12(15)14-9-11-6-4-5-7-13-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyJTLRWWDGFSEHCT-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.68
Rot. Bonds5

About 3-methyl-N-(piperidin-2-ylmethyl)pentanamide

3-methyl-N-(piperidin-2-ylmethyl)pentanamide (PubChem CID 114874123) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-methyl-N-(piperidin-2-ylmethyl)pentanamide.

Molecular Properties

Compound Name3-methyl-N-(piperidin-2-ylmethyl)pentanamide
PubChem CID114874123
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-methyl-N-(piperidin-2-ylmethyl)pentanamide
SMILESCCC(C)CC(=O)NCC1CCCCN1
InChIInChI=1S/C12H24N2O/c1-3-10(2)8-12(15)14-9-11-6-4-5-7-13-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyJTLRWWDGFSEHCT-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(piperidin-2-ylmethyl)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

3-ethyl-N-(pyrrolidin-2-ylmethyl)pentanamide;hydrochloride
CID 119511693
3-ethyl-4-methyl-N-(pyrrolidin-2-ylmethyl)pentanamide;hydrochloride
CID 119510156
3-butyl-N-[[(2R)-pyrrolidin-2-yl]methyl]octanamide
CID 70821146
3-butyl-N-[[(2S)-pyrrolidin-2-yl]methyl]octanamide
CID 70821149
[(2S)-piperidin-2-yl]methylcarbamic acid
CID 67090489
2-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)acetamide
CID 112701289
4-methyl-N-(piperidin-2-ylmethyl)hexan-2-amine
CID 106634056
2-chloro-N-(pyrrolidin-2-ylmethyl)acetamide
CID 71302527
(2R)-2-hydroxy-N-(pyrrolidin-2-ylmethyl)propanamide
CID 126992577
(2S)-2-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]propanamide
CID 130985831
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-3-methylpentanamide
CID 114875423
N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
CID 175666343

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(piperidin-2-ylmethyl)pentanamide?
The IUPAC name of 3-methyl-N-(piperidin-2-ylmethyl)pentanamide (CID 114874123) is 3-methyl-N-(piperidin-2-ylmethyl)pentanamide.
What is the SMILES notation for 3-methyl-N-(piperidin-2-ylmethyl)pentanamide?
The canonical SMILES for 3-methyl-N-(piperidin-2-ylmethyl)pentanamide is CCC(C)CC(=O)NCC1CCCCN1.
What is the InChIKey of 3-methyl-N-(piperidin-2-ylmethyl)pentanamide?
The InChIKey is JTLRWWDGFSEHCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-3-10(2)8-12(15)14-9-11-6-4-5-7-13-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of 3-methyl-N-(piperidin-2-ylmethyl)pentanamide?
3-methyl-N-(piperidin-2-ylmethyl)pentanamide has a molecular weight of 212.34 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(piperidin-2-ylmethyl)pentanamide is sourced from PubChem (CID 114874123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).