N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride

C12H27ClN2O2 — CID 119523589

IUPACN-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride
SMILESCC(C)CCOC(C)C(=O)NC(C)(C)CN.Cl
InChIInChI=1S/C12H26N2O2.ClH/c1-9(2)6-7-16-10(3)11(15)14-12(4,5)8-13;/h9-10H,6-8,13H2,1-5H3,(H,14,15);1H
InChIKeyNXTKNUNDYGWZMP-UHFFFAOYSA-N
MW266.81 g/mol
LogP1.71
Rot. Bonds7

About N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride

N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride (PubChem CID 119523589) has the molecular formula C12H27ClN2O2 and a molecular weight of 266.81 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride
PubChem CID119523589
Molecular FormulaC12H27ClN2O2
Molecular Weight266.81 g/mol
Exact Mass266.18
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride
SMILESCC(C)CCOC(C)C(=O)NC(C)(C)CN.Cl
InChIInChI=1S/C12H26N2O2.ClH/c1-9(2)6-7-16-10(3)11(15)14-12(4,5)8-13;/h9-10H,6-8,13H2,1-5H3,(H,14,15);1H
InChIKeyNXTKNUNDYGWZMP-UHFFFAOYSA-N
XLogP1.71
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.81
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride
CID 119524579
N-(3-aminopropyl)-2-(3-methylbutoxy)propanamide;hydrochloride
CID 119407306
N-(1-amino-2-methylpropan-2-yl)-2-(oxan-2-ylmethoxy)propanamide;hydrochloride
CID 119525083
N-(1-amino-2,4-dimethylpentan-2-yl)-2-but-3-enoxypropanamide
CID 119600308
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-ethoxyethoxy)propanamide
CID 119599208
N-[2-(ethylamino)ethyl]-2-(3-methylbutoxy)propanamide;hydrochloride
CID 119507501
CID 89196505
CID 89196505
N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutylsulfanyl)acetamide;hydrochloride
CID 119524067
N-(1-amino-2-cyclopropylpropan-2-yl)-2-butoxypropanamide
CID 119575434
N-(1-amino-2-methylpropan-2-yl)-2-cyclopropylpropanamide
CID 81479173
2-aminooxy-N-(2-methylbutan-2-yl)propanamide
CID 79426922
N-(1-amino-2-methylpropan-2-yl)-2-(3-chlorophenoxy)propanamide
CID 63193676

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride (CID 119523589) is N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride is CC(C)CCOC(C)C(=O)NC(C)(C)CN.Cl.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride?
The InChIKey is NXTKNUNDYGWZMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2.ClH/c1-9(2)6-7-16-10(3)11(15)14-12(4,5)8-13;/h9-10H,6-8,13H2,1-5H3,(H,14,15);1H.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride?
N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride has a molecular weight of 266.81 g/mol, XLogP of 1.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride is sourced from PubChem (CID 119523589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).