2-[4-(methylaminomethyl)piperidin-1-yl]acetamide

C9H19N3O — CID 63248963

IUPAC2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
SMILESCNCC1CCN(CC(N)=O)CC1
InChIInChI=1S/C9H19N3O/c1-11-6-8-2-4-12(5-3-8)7-9(10)13/h8,11H,2-7H2,1H3,(H2,10,13)
InChIKeyXGXUHHUDMIPLAX-UHFFFAOYSA-N
MW185.27 g/mol
LogP-0.60
Rot. Bonds4

About 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide

2-[4-(methylaminomethyl)piperidin-1-yl]acetamide (PubChem CID 63248963) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
PubChem CID63248963
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
SMILESCNCC1CCN(CC(N)=O)CC1
InChIInChI=1S/C9H19N3O/c1-11-6-8-2-4-12(5-3-8)7-9(10)13/h8,11H,2-7H2,1H3,(H2,10,13)
InChIKeyXGXUHHUDMIPLAX-UHFFFAOYSA-N
XLogP-0.60
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethylpiperidin-1-yl)acetamide
CID 23381133
N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63248525
4-(methylaminomethyl)piperidine-1-carboxamide
CID 63248763
propan-2-yl 2-[4-(methylaminomethyl)piperidin-1-yl]acetate
CID 63248775
N,N-diethyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63249005
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119922349
2-[4-[1-[[3-(3,5-dichlorophenyl)-5-[[4-(methylaminomethyl)piperidin-1-yl]methyl]phenyl]methyl]piperidin-4-yl]piperidin-1-yl]acetamide
CID 176957106
1-[1-(aminomethyl)piperidin-4-yl]-N-methylmethanamine
CID 146320414
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 63248872
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 63248834
N-cyclohexyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922360
1-[4-(methylaminomethyl)piperidin-1-yl]ethanone
CID 22983130

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide (CID 63248963) is 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide is CNCC1CCN(CC(N)=O)CC1.
What is the InChIKey of 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The InChIKey is XGXUHHUDMIPLAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-11-6-8-2-4-12(5-3-8)7-9(10)13/h8,11H,2-7H2,1H3,(H2,10,13).
What are the key properties of 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
2-[4-(methylaminomethyl)piperidin-1-yl]acetamide has a molecular weight of 185.27 g/mol, XLogP of -0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylaminomethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 63248963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).