2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride

C12H23ClN2O2 — CID 119782237

IUPAC2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride
SMILESCC1(CNC(=O)CNCC2CC2)CCCO1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-12(5-2-6-16-12)9-14-11(15)8-13-7-10-3-4-10;/h10,13H,2-9H2,1H3,(H,14,15);1H
InChIKeyMRDLMAUSJKTTMC-UHFFFAOYSA-N
MW262.78 g/mol
LogP1.09
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride (PubChem CID 119782237) has the molecular formula C12H23ClN2O2 and a molecular weight of 262.78 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride
PubChem CID119782237
Molecular FormulaC12H23ClN2O2
Molecular Weight262.78 g/mol
Exact Mass262.14
IUPAC Name2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride
SMILESCC1(CNC(=O)CNCC2CC2)CCCO1.Cl
InChIInChI=1S/C12H22N2O2.ClH/c1-12(5-2-6-16-12)9-14-11(15)8-13-7-10-3-4-10;/h10,13H,2-9H2,1H3,(H,14,15);1H
InChIKeyMRDLMAUSJKTTMC-UHFFFAOYSA-N
XLogP1.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.78
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride
CID 119782238
2-(cyclopropylmethylamino)-N-[(1-propylcyclobutyl)methyl]acetamide;hydrochloride
CID 119821719
N-(cyclopropylmethyl)-2-[(1-methylcyclopentyl)methylamino]acetamide
CID 63821683
2-(cyclopropylmethylamino)-N-[(1-ethylcyclopentyl)methyl]acetamide
CID 103812610
4-amino-N-[(2-methyloxolan-2-yl)methyl]butanamide;hydrochloride
CID 119322777
2-(cyclopropylmethylamino)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 119682315
1-[[(2R)-2-methyloxolan-2-yl]methyl]-3-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl]urea
CID 99827527
N-(cyclopropylmethyl)-2-[(1-hydroxycyclohexyl)methylamino]acetamide
CID 65108692
2-(cyclopropylmethylamino)-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]acetamide;hydrochloride
CID 119820320
2-(cyclopropylmethylamino)-N-[(1-hydroxy-4-methylcyclohexyl)methyl]acetamide
CID 65119831
N-[(2-methyloxolan-2-yl)methyl]-3-piperidin-4-ylbutanamide
CID 119782244
(2S)-N-[(2-methyloxolan-2-yl)methyl]piperidine-2-carboxamide;hydrochloride
CID 119782231

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride (CID 119782237) is 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride is CC1(CNC(=O)CNCC2CC2)CCCO1.Cl.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride?
The InChIKey is MRDLMAUSJKTTMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2.ClH/c1-12(5-2-6-16-12)9-14-11(15)8-13-7-10-3-4-10;/h10,13H,2-9H2,1H3,(H,14,15);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride has a molecular weight of 262.78 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[(2-methyloxolan-2-yl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 119782237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).