3-(2-methylpiperidin-1-yl)propanamide

C9H18N2O — CID 15121454

IUPAC3-(2-methylpiperidin-1-yl)propanamide
SMILESCC1CCCCN1CCC(N)=O
InChIInChI=1S/C9H18N2O/c1-8-4-2-3-6-11(8)7-5-9(10)12/h8H,2-7H2,1H3,(H2,10,12)
InChIKeyBUAQVWZRXIZFFG-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.74
Rot. Bonds3

About 3-(2-methylpiperidin-1-yl)propanamide

3-(2-methylpiperidin-1-yl)propanamide (PubChem CID 15121454) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 3-(2-methylpiperidin-1-yl)propanamide.

Molecular Properties

Compound Name3-(2-methylpiperidin-1-yl)propanamide
PubChem CID15121454
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name3-(2-methylpiperidin-1-yl)propanamide
SMILESCC1CCCCN1CCC(N)=O
InChIInChI=1S/C9H18N2O/c1-8-4-2-3-6-11(8)7-5-9(10)12/h8H,2-7H2,1H3,(H2,10,12)
InChIKeyBUAQVWZRXIZFFG-UHFFFAOYSA-N
XLogP0.74
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methylpiperidin-1-yl)propanehydrazide
CID 60676133
methyl 3-(2-methylazepan-1-yl)propanoate;hydrochloride
CID 20846518
N'-hydroxy-5-(2-methylpiperidin-1-yl)pentanimidamide
CID 109374519
2-[(2R)-2-methylpyrrolidin-1-yl]acetamide
CID 167235673
2-[3-(2-methylpiperidin-1-yl)propanoylamino]acetic acid
CID 52983761
3-[(2S,6R)-2,6-dimethylpiperidin-1-yl]propanamide
CID 92917685
hydrazinyl 3-(2-methylpyrrolidin-1-yl)propanoate
CID 66339308
3-[3-(2-methylpiperidin-1-yl)propanoylamino]butanoic acid
CID 53215711
1-(4-chlorophenyl)-3-(2-methylpiperidin-1-yl)propan-1-one
CID 62617497
3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 62737703
4-(2-methylpiperidin-1-yl)but-2-enamide
CID 141030291
1-(3-aminophenyl)-3-(2-methylpiperidin-1-yl)propan-1-one
CID 82071339

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpiperidin-1-yl)propanamide?
The IUPAC name of 3-(2-methylpiperidin-1-yl)propanamide (CID 15121454) is 3-(2-methylpiperidin-1-yl)propanamide.
What is the SMILES notation for 3-(2-methylpiperidin-1-yl)propanamide?
The canonical SMILES for 3-(2-methylpiperidin-1-yl)propanamide is CC1CCCCN1CCC(N)=O.
What is the InChIKey of 3-(2-methylpiperidin-1-yl)propanamide?
The InChIKey is BUAQVWZRXIZFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-8-4-2-3-6-11(8)7-5-9(10)12/h8H,2-7H2,1H3,(H2,10,12).
What are the key properties of 3-(2-methylpiperidin-1-yl)propanamide?
3-(2-methylpiperidin-1-yl)propanamide has a molecular weight of 170.26 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpiperidin-1-yl)propanamide is sourced from PubChem (CID 15121454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).