N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide

C10H21N3O — CID 66567390

IUPACN-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(CCN)CC1
InChIInChI=1S/C10H21N3O/c1-9(14)12-8-10-2-5-13(6-3-10)7-4-11/h10H,2-8,11H2,1H3,(H,12,14)
InChIKeyXGNWLRIEBUADEO-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.21
Rot. Bonds4

About N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide

N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide (PubChem CID 66567390) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide
PubChem CID66567390
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1CCN(CCN)CC1
InChIInChI=1S/C10H21N3O/c1-9(14)12-8-10-2-5-13(6-3-10)7-4-11/h10H,2-8,11H2,1H3,(H,12,14)
InChIKeyXGNWLRIEBUADEO-UHFFFAOYSA-N
XLogP-0.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(4-aminobutyl)piperidin-4-yl]methyl]acetamide
CID 102736096
N-[[1-(3-hydrazinyl-3-oxopropyl)piperidin-4-yl]methyl]acetamide
CID 102737013
N-[(1-ethylpiperidin-4-yl)methyl]acetamide
CID 60968762
N-[[1-(2-piperazin-1-ylethyl)piperidin-4-yl]methyl]acetamide
CID 102736381
N-[[1-(5-oxohexyl)piperidin-4-yl]methyl]acetamide
CID 102736688
N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]-3,5-dimethylbenzamide
CID 130216559
N-[[1-[(2S)-2-hydroxypropyl]piperidin-4-yl]methyl]acetamide
CID 106932924
N-[(1-prop-2-enylpiperidin-4-yl)methyl]acetamide
CID 51116338
N-[[1-(2-aminoethylsulfonyl)piperidin-4-yl]methyl]acetamide
CID 102736166
N-[[1-(3-oxo-3-piperazin-1-ylpropyl)piperidin-4-yl]methyl]acetamide
CID 102736385
N-[[4-(aminomethyl)cyclohexyl]methyl]acetamide
CID 45119594
N-[[1-(2,2-dimethoxyethyl)piperidin-4-yl]methyl]acetamide
CID 105346505

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide (CID 66567390) is N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1CCN(CCN)CC1.
What is the InChIKey of N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide?
The InChIKey is XGNWLRIEBUADEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-9(14)12-8-10-2-5-13(6-3-10)7-4-11/h10H,2-8,11H2,1H3,(H,12,14).
What are the key properties of N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide?
N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide has a molecular weight of 199.30 g/mol, XLogP of -0.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-aminoethyl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 66567390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).