2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride

C12H25ClN2O — CID 119785992

IUPAC2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride
SMILESCCC(C)(CC)NC(=O)CNCC1CC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-4-12(3,5-2)14-11(15)9-13-8-10-6-7-10;/h10,13H,4-9H2,1-3H3,(H,14,15);1H
InChIKeyBQDXZLZMZDFAIM-UHFFFAOYSA-N
MW248.80 g/mol
LogP2.10
Rot. Bonds7

About 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride

2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride (PubChem CID 119785992) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride
PubChem CID119785992
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride
SMILESCCC(C)(CC)NC(=O)CNCC1CC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-4-12(3,5-2)14-11(15)9-13-8-10-6-7-10;/h10,13H,4-9H2,1-3H3,(H,14,15);1H
InChIKeyBQDXZLZMZDFAIM-UHFFFAOYSA-N
XLogP2.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 61486055
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CID 60841585
N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide
CID 115356303
2-cyclopropyl-N-(1-hydroxy-3-methylpentan-3-yl)acetamide
CID 103945988
2-(cyclopropylmethylamino)-N-(2-hydroxy-2-methylpropyl)acetamide
CID 65107560
2-[(3-hydroxycyclobutyl)methylamino]-N-(2-methylbutan-2-yl)acetamide
CID 66005947
2-(cyclopropylmethylamino)-N-(4-ethylcyclohexyl)acetamide;hydrochloride
CID 119716167
2-(cyclopropylmethylamino)-N-(2-methyl-4-phenylbutan-2-yl)acetamide;hydrochloride
CID 119772417
2-[(1-ethylpyrrolidin-3-yl)methylamino]-N-(2-methylbutan-2-yl)acetamide
CID 54955961
2-(cyclohexylmethylamino)-N-(3-ethylpent-1-yn-3-yl)acetamide;methanamine
CID 143903152
N-[2-(tert-butylamino)-2-oxoethyl]-2-(cyclopropylmethylamino)-N-methylacetamide;hydrochloride
CID 119691966
3-(3-cyclopropylpropanoylamino)-3-methylpentanoic acid
CID 115730882

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride (CID 119785992) is 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride is CCC(C)(CC)NC(=O)CNCC1CC1.Cl.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride?
The InChIKey is BQDXZLZMZDFAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-4-12(3,5-2)14-11(15)9-13-8-10-6-7-10;/h10,13H,4-9H2,1-3H3,(H,14,15);1H.
What are the key properties of 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride?
2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 2.10, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 119785992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).