N-(azetidin-3-ylmethyl)acetamide;hydrochloride

C6H13ClN2O — CID 15615456

IUPACN-(azetidin-3-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)NCC1CNC1.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-5(9)8-4-6-2-7-3-6;/h6-7H,2-4H2,1H3,(H,8,9);1H
InChIKeyLHUVQCSAAKBTLK-UHFFFAOYSA-N
MW164.64 g/mol
LogP-0.24
Rot. Bonds2

About N-(azetidin-3-ylmethyl)acetamide;hydrochloride

N-(azetidin-3-ylmethyl)acetamide;hydrochloride (PubChem CID 15615456) has the molecular formula C6H13ClN2O and a molecular weight of 164.64 g/mol. Its IUPAC name is N-(azetidin-3-ylmethyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(azetidin-3-ylmethyl)acetamide;hydrochloride
PubChem CID15615456
Molecular FormulaC6H13ClN2O
Molecular Weight164.64 g/mol
Exact Mass164.07
IUPAC NameN-(azetidin-3-ylmethyl)acetamide;hydrochloride
SMILESCC(=O)NCC1CNC1.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-5(9)8-4-6-2-7-3-6;/h6-7H,2-4H2,1H3,(H,8,9);1H
InChIKeyLHUVQCSAAKBTLK-UHFFFAOYSA-N
XLogP-0.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.64
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-Isobutylacetamide
CID 137071
N-(3-aminopropyl)acetamide
CID 13793967
N-ethylazetidine-3-carboxamide
CID 65963358
N-methylazetidine-3-carboxamide
CID 59597796
Azetidine-3-carboxamide hydrochloride
CID 23051769
N-[(azetidin-3-yl)methyl]-2,2,2-trifluoroacetamide hydrochloride
CID 23051792
N-Acetyl-2-methyl-1,3-propanediamine
CID 44629783
N,N-dimethylazetidine-3-carboxamide hydrochloride
CID 53308702
3-amino-N-(2-methylpropyl)propanamide hydrochloride
CID 53409687
1-[3-(Aminomethyl)azetidin-1-yl]ethan-1-one
CID 64989017
N-methylazetidine-3-carboxamide hydrochloride
CID 69007600
N-(3-aminopropyl)-2-methylpropanamide hydrochloride
CID 71757297

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-ylmethyl)acetamide;hydrochloride?
The IUPAC name of N-(azetidin-3-ylmethyl)acetamide;hydrochloride (CID 15615456) is N-(azetidin-3-ylmethyl)acetamide;hydrochloride.
What is the SMILES notation for N-(azetidin-3-ylmethyl)acetamide;hydrochloride?
The canonical SMILES for N-(azetidin-3-ylmethyl)acetamide;hydrochloride is CC(=O)NCC1CNC1.Cl.
What is the InChIKey of N-(azetidin-3-ylmethyl)acetamide;hydrochloride?
The InChIKey is LHUVQCSAAKBTLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.ClH/c1-5(9)8-4-6-2-7-3-6;/h6-7H,2-4H2,1H3,(H,8,9);1H.
What are the key properties of N-(azetidin-3-ylmethyl)acetamide;hydrochloride?
N-(azetidin-3-ylmethyl)acetamide;hydrochloride has a molecular weight of 164.64 g/mol, XLogP of -0.24, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-ylmethyl)acetamide;hydrochloride is sourced from PubChem (CID 15615456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).