2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride

C10H21ClN2O2 — CID 119801745

IUPAC2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride
SMILESCNCC(=O)NC(C)C1CCOCC1.Cl
InChIInChI=1S/C10H20N2O2.ClH/c1-8(12-10(13)7-11-2)9-3-5-14-6-4-9;/h8-9,11H,3-7H2,1-2H3,(H,12,13);1H
InChIKeyAVHIWEXICMQBRF-UHFFFAOYSA-N
MW236.74 g/mol
LogP0.56
Rot. Bonds4

About 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride

2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride (PubChem CID 119801745) has the molecular formula C10H21ClN2O2 and a molecular weight of 236.74 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride
PubChem CID119801745
Molecular FormulaC10H21ClN2O2
Molecular Weight236.74 g/mol
Exact Mass236.13
IUPAC Name2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride
SMILESCNCC(=O)NC(C)C1CCOCC1.Cl
InChIInChI=1S/C10H20N2O2.ClH/c1-8(12-10(13)7-11-2)9-3-5-14-6-4-9;/h8-9,11H,3-7H2,1-2H3,(H,12,13);1H
InChIKeyAVHIWEXICMQBRF-UHFFFAOYSA-N
XLogP0.56
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.74
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(oxan-4-yl)ethyl]butanamide
CID 103769211
N-[1-(oxan-4-yl)ethyl]cyclopropanecarboxamide
CID 103769201
2-(4-aminophenyl)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride
CID 119801734
4-amino-N-[1-(oxan-4-yl)ethyl]butanamide
CID 103797662
2-[1-(oxan-4-yl)ethylamino]-N-pentan-2-ylacetamide
CID 103914830
6-amino-4-methyl-N-[1-(oxan-4-yl)ethyl]hexanamide
CID 114115149
3-(tert-butylamino)-N-[1-(oxan-4-yl)ethyl]propanamide
CID 114115155
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride
CID 119801753
4-amino-3-methoxy-N-[1-(oxan-4-yl)ethyl]butanamide
CID 107093451
2-amino-N-[1-(oxolan-3-yl)ethyl]acetamide
CID 115734721
(2S)-2-amino-N-[1-(oxan-4-yl)ethyl]butanamide
CID 103797658
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride?
The IUPAC name of 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride (CID 119801745) is 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride is CNCC(=O)NC(C)C1CCOCC1.Cl.
What is the InChIKey of 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride?
The InChIKey is AVHIWEXICMQBRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2.ClH/c1-8(12-10(13)7-11-2)9-3-5-14-6-4-9;/h8-9,11H,3-7H2,1-2H3,(H,12,13);1H.
What are the key properties of 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride?
2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride has a molecular weight of 236.74 g/mol, XLogP of 0.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-(oxan-4-yl)ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119801745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).