2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride

C13H25ClN2O2 — CID 119746345

IUPAC2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride
SMILESCN(CC1CCCCO1)C(=O)CNCC1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-15(10-12-4-2-3-7-17-12)13(16)9-14-8-11-5-6-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyYIQRIQUYZXRLGG-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.44
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride (PubChem CID 119746345) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride
PubChem CID119746345
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC Name2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride
SMILESCN(CC1CCCCO1)C(=O)CNCC1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-15(10-12-4-2-3-7-17-12)13(16)9-14-8-11-5-6-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyYIQRIQUYZXRLGG-UHFFFAOYSA-N
XLogP1.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 61436031
N-methyl-N-(oxan-2-ylmethyl)cyclopropanecarboxamide
CID 61150958
2-(1-hydroxycyclohexyl)-N-methyl-N-(oxan-2-ylmethyl)acetamide
CID 111537176
N-methyl-N-(oxolan-2-ylmethyl)-2-piperidin-4-ylacetamide
CID 61435803
2-(cycloheptylmethylamino)-N-ethyl-N-methylacetamide
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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride (CID 119746345) is 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride is CN(CC1CCCCO1)C(=O)CNCC1CC1.Cl.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride?
The InChIKey is YIQRIQUYZXRLGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-15(10-12-4-2-3-7-17-12)13(16)9-14-8-11-5-6-11;/h11-12,14H,2-10H2,1H3;1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-methyl-N-(oxan-2-ylmethyl)acetamide;hydrochloride is sourced from PubChem (CID 119746345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).