2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide

C13H24N4O2 — CID 114961027

IUPAC2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
SMILESCC1CCN(CC(=O)NC(=O)NC2CC2)CC1CN
InChIInChI=1S/C13H24N4O2/c1-9-4-5-17(7-10(9)6-14)8-12(18)16-13(19)15-11-2-3-11/h9-11H,2-8,14H2,1H3,(H2,15,16,18,19)
InChIKeyFPSHIHQHHMKNEY-UHFFFAOYSA-N
MW268.36 g/mol
LogP-0.11
Rot. Bonds4

About 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide

2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide (PubChem CID 114961027) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
PubChem CID114961027
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
SMILESCC1CCN(CC(=O)NC(=O)NC2CC2)CC1CN
InChIInChI=1S/C13H24N4O2/c1-9-4-5-17(7-10(9)6-14)8-12(18)16-13(19)15-11-2-3-11/h9-11H,2-8,14H2,1H3,(H2,15,16,18,19)
InChIKeyFPSHIHQHHMKNEY-UHFFFAOYSA-N
XLogP-0.11
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylcarbamoyl)-2-(3-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 103898008
2-[2-(aminomethyl)morpholin-4-yl]-N-(cyclopropylcarbamoyl)acetamide
CID 114394847
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 114876490
N-(cyclopropylcarbamoyl)-2-[3-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62371580
N-(cyclopropylcarbamoyl)-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 17421099
N-(cyclopropylcarbamoyl)-2-(4-methoxypiperidin-1-yl)acetamide
CID 47131574
N-(cyclohexylcarbamoyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 2655086
N-(cyclohexylcarbamoyl)-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905800
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N,N-bis(2-methylpropyl)acetamide
CID 114960951
2-[3-(1-aminoethyl)piperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide;hydrochloride
CID 119925640
N-cyclopropyl-2-(4-hydroxy-3-methylpiperidin-1-yl)acetamide
CID 114502743
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 114961096

Frequently Asked Questions

What is the IUPAC name of 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide?
The IUPAC name of 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide (CID 114961027) is 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide.
What is the SMILES notation for 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide?
The canonical SMILES for 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide is CC1CCN(CC(=O)NC(=O)NC2CC2)CC1CN.
What is the InChIKey of 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide?
The InChIKey is FPSHIHQHHMKNEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-9-4-5-17(7-10(9)6-14)8-12(18)16-13(19)15-11-2-3-11/h9-11H,2-8,14H2,1H3,(H2,15,16,18,19).
What are the key properties of 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide?
2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide has a molecular weight of 268.36 g/mol, XLogP of -0.11, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(aminomethyl)-4-methylpiperidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide is sourced from PubChem (CID 114961027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).