N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide

C12H25N3O — CID 115373436

IUPACN-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide
SMILESCCCN(CC(=O)NC)C1CNCC(C)C1
InChIInChI=1S/C12H25N3O/c1-4-5-15(9-12(16)13-3)11-6-10(2)7-14-8-11/h10-11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyKARGPOACARKIMZ-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.44
Rot. Bonds5

About N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide

N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide (PubChem CID 115373436) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide
PubChem CID115373436
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide
SMILESCCCN(CC(=O)NC)C1CNCC(C)C1
InChIInChI=1S/C12H25N3O/c1-4-5-15(9-12(16)13-3)11-6-10(2)7-14-8-11/h10-11,14H,4-9H2,1-3H3,(H,13,16)
InChIKeyKARGPOACARKIMZ-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[(4-methylpyrrolidin-3-yl)-propylamino]acetamide
CID 81459217
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
2-[azetidin-3-yl(propyl)amino]-N-(4-fluorophenyl)acetamide
CID 66213900
2-[ethyl-(5-methylpiperidin-3-yl)amino]acetamide
CID 103102723
N-methyl-2-[(3-oxocyclopentyl)-propylamino]acetamide
CID 79643633
N,N-diethyl-5-methylpiperidin-3-amine
CID 115373351
2-[azetidin-3-yl(propyl)amino]-1-(3,5-dimethylpiperidin-1-yl)ethanone
CID 66216113
2-[azetidin-3-yl(propyl)amino]-N,N-dimethylacetamide
CID 62784248
N-(4-methylcyclohexyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921661
2-[azetidin-3-yl(propyl)amino]-N-(tert-butylcarbamoyl)acetamide
CID 66216311
N-ethyl-2-[piperidin-3-yl(propyl)amino]acetamide
CID 63638025
2-[azetidin-3-yl(propyl)amino]-N-(2,3-dimethylcyclohexyl)acetamide
CID 66213902

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide?
The IUPAC name of N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide (CID 115373436) is N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide.
What is the SMILES notation for N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide?
The canonical SMILES for N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide is CCCN(CC(=O)NC)C1CNCC(C)C1.
What is the InChIKey of N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide?
The InChIKey is KARGPOACARKIMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-5-15(9-12(16)13-3)11-6-10(2)7-14-8-11/h10-11,14H,4-9H2,1-3H3,(H,13,16).
What are the key properties of N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide?
N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide has a molecular weight of 227.35 g/mol, XLogP of 0.44, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-methylpiperidin-3-yl)-propylamino]acetamide is sourced from PubChem (CID 115373436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).