2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide

C14H27N3O — CID 107160510

IUPAC2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide
SMILESCC1(CN)CCN(CC(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-14(11-15)6-8-17(9-7-14)10-13(18)16-12-4-2-3-5-12/h12H,2-11,15H2,1H3,(H,16,18)
InChIKeyTYQOROPPGVMWNS-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.11
Rot. Bonds4

About 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide

2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide (PubChem CID 107160510) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide
PubChem CID107160510
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide
SMILESCC1(CN)CCN(CC(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O/c1-14(11-15)6-8-17(9-7-14)10-13(18)16-12-4-2-3-5-12/h12H,2-11,15H2,1H3,(H,16,18)
InChIKeyTYQOROPPGVMWNS-UHFFFAOYSA-N
XLogP1.11
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-cyclopropylacetamide;hydrochloride
CID 120772051
2-(4-carbamothioyl-4-methylpiperidin-1-yl)-N-cycloheptylacetamide
CID 107161620
1-[2-(cyclopentylamino)-2-oxoethyl]-4-ethylpiperidine-4-carboxylic acid
CID 63126585
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-(2,3-dimethylcyclohexyl)acetamide
CID 120771673
N-cyclopropyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
CID 103728808
2-(4-hydroxy-4-methylazepan-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 107407896
1-[2-(cycloheptylamino)-2-oxoethyl]-3-ethylpyrrolidine-3-carboxylic acid
CID 63148645
1-[2-(cyclooctylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 119908022
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]acetohydrazide
CID 130562628
N-cyclohexyl-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 60968203
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-1-(azepan-1-yl)ethanone
CID 107160703
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-(2-cyclohexylethyl)acetamide;hydrochloride
CID 120772426

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide?
The IUPAC name of 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide (CID 107160510) is 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide?
The canonical SMILES for 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide is CC1(CN)CCN(CC(=O)NC2CCCC2)CC1.
What is the InChIKey of 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide?
The InChIKey is TYQOROPPGVMWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-14(11-15)6-8-17(9-7-14)10-13(18)16-12-4-2-3-5-12/h12H,2-11,15H2,1H3,(H,16,18).
What are the key properties of 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide?
2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide has a molecular weight of 253.39 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-N-cyclopentylacetamide is sourced from PubChem (CID 107160510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).