N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride

C13H25ClN2O2 — CID 119813290

IUPACN-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride
SMILESCN(CCOCC1CC1)C(=O)CNCC1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-15(6-7-17-10-12-4-5-12)13(16)9-14-8-11-2-3-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyRWWZGCBMVOKXSC-UHFFFAOYSA-N
MW276.81 g/mol
LogP1.29
Rot. Bonds9

About N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride

N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride (PubChem CID 119813290) has the molecular formula C13H25ClN2O2 and a molecular weight of 276.81 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride
PubChem CID119813290
Molecular FormulaC13H25ClN2O2
Molecular Weight276.81 g/mol
Exact Mass276.16
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride
SMILESCN(CCOCC1CC1)C(=O)CNCC1CC1.Cl
InChIInChI=1S/C13H24N2O2.ClH/c1-15(6-7-17-10-12-4-5-12)13(16)9-14-8-11-2-3-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyRWWZGCBMVOKXSC-UHFFFAOYSA-N
XLogP1.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.81
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropylmethylamino)-N-(2-methoxyethyl)-N-methylacetamide
CID 61042213
N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-3-sulfanylpropanamide
CID 107032708
2-(cyclopropylmethylamino)-N-(3-methoxypropyl)-N-methylacetamide
CID 63008232
N-[2-(cyclopropylmethoxy)ethyl]-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119813303
N-[2-(cyclopropylmethoxy)ethyl]-2-hydroxy-N,2-dimethylpropanamide
CID 103430227
3-cyclohexyl-1-[2-(cyclopropylmethoxy)ethyl]-1-methylurea
CID 115686592
N-[2-(cyclopropylmethoxy)ethyl]-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119340564
3-[2-(cyclopropylmethoxy)ethyl-methylamino]-2,2-dimethyl-3-oxopropanoic acid
CID 82821123
1-[[2-(cyclopropylmethoxy)ethyl-methylcarbamoyl]amino]cyclobutane-1-carboxylic acid
CID 81163350
methyl 2-[2-(cyclopropylmethoxy)ethyl-methylamino]acetate
CID 79006432
N-[2-(tert-butylamino)-2-oxoethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride
CID 119691966
2-(cyclopropylmethylamino)-N-methyl-N-(2-thiophen-2-ylethyl)acetamide;hydrochloride
CID 119807077

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride (CID 119813290) is N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride is CN(CCOCC1CC1)C(=O)CNCC1CC1.Cl.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride?
The InChIKey is RWWZGCBMVOKXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2.ClH/c1-15(6-7-17-10-12-4-5-12)13(16)9-14-8-11-2-3-11;/h11-12,14H,2-10H2,1H3;1H.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride?
N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride has a molecular weight of 276.81 g/mol, XLogP of 1.29, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride is sourced from PubChem (CID 119813290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).