N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

C11H25ClN2O2 — CID 119813456

IUPACN-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCC(OC)C(C)C.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-8(2)10(15-5)7-13-11(14)9(3)6-12-4;/h8-10,12H,6-7H2,1-5H3,(H,13,14);1H
InChIKeyTUMHBHQANBGIHE-UHFFFAOYSA-N
MW252.79 g/mol
LogP1.05
Rot. Bonds7

About N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (PubChem CID 119813456) has the molecular formula C11H25ClN2O2 and a molecular weight of 252.79 g/mol. Its IUPAC name is N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
PubChem CID119813456
Molecular FormulaC11H25ClN2O2
Molecular Weight252.79 g/mol
Exact Mass252.16
IUPAC NameN-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCC(OC)C(C)C.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-8(2)10(15-5)7-13-11(14)9(3)6-12-4;/h8-10,12H,6-7H2,1-5H3,(H,13,14);1H
InChIKeyTUMHBHQANBGIHE-UHFFFAOYSA-N
XLogP1.05
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.79
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 119703920
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CID 103811142
N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
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2-methyl-N-[2-methyl-3-(methylamino)propyl]butanamide
CID 81478398
N-[(4-hydroxycyclohexyl)methyl]-2-methyl-3-(methylamino)propanamide
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methyl 6-[[2-methyl-3-(methylamino)propanoyl]amino]hexanoate
CID 119686226
2-methyl-3-(methylamino)-N-[2-(propan-2-ylsulfamoyl)ethyl]propanamide;hydrochloride
CID 119758899
N-(cyclobutylmethyl)-2-methyl-3-(methylamino)propanamide
CID 79196076
2-methyl-3-(methylamino)-N-(2-methylsulfanylethyl)propanamide
CID 79202458
2-methyl-3-(methylamino)-N-(3-methyl-2-phenylbutyl)propanamide
CID 119732056
N-(2-but-3-enoxyethyl)-2-methyl-3-(methylamino)propanamide
CID 106398280
2-[(2-methoxy-3-methylbutyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120976511

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The IUPAC name of N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (CID 119813456) is N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.
What is the SMILES notation for N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The canonical SMILES for N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is CNCC(C)C(=O)NCC(OC)C(C)C.Cl.
What is the InChIKey of N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The InChIKey is TUMHBHQANBGIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2.ClH/c1-8(2)10(15-5)7-13-11(14)9(3)6-12-4;/h8-10,12H,6-7H2,1-5H3,(H,13,14);1H.
What are the key properties of N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride has a molecular weight of 252.79 g/mol, XLogP of 1.05, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-3-methylbutyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is sourced from PubChem (CID 119813456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).