N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride

C11H25ClN2O2 — CID 119524579

IUPACN-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride
SMILESCCCCOC(C)C(=O)NC(C)(C)CN.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-5-6-7-15-9(2)10(14)13-11(3,4)8-12;/h9H,5-8,12H2,1-4H3,(H,13,14);1H
InChIKeyFCKFLIRRRZPUPL-UHFFFAOYSA-N
MW252.79 g/mol
LogP1.47
Rot. Bonds7

About N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride

N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride (PubChem CID 119524579) has the molecular formula C11H25ClN2O2 and a molecular weight of 252.79 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride
PubChem CID119524579
Molecular FormulaC11H25ClN2O2
Molecular Weight252.79 g/mol
Exact Mass252.16
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride
SMILESCCCCOC(C)C(=O)NC(C)(C)CN.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-5-6-7-15-9(2)10(14)13-11(3,4)8-12;/h9H,5-8,12H2,1-4H3,(H,13,14);1H
InChIKeyFCKFLIRRRZPUPL-UHFFFAOYSA-N
XLogP1.47
TPSA64.35 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 ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-2-(3-methylbutoxy)propanamide;hydrochloride
CID 119523589
N-(1-amino-2-cyclopropylpropan-2-yl)-2-butoxypropanamide
CID 119575434
N-(1-amino-4-methylpentan-2-yl)-2-butoxypropanamide
CID 119588291
N-(1-amino-2-methylpropan-2-yl)-2-(oxan-2-ylmethoxy)propanamide;hydrochloride
CID 119525083
1,1,3,3-tetrabutoxypropan-2-one
CID 546234
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-ethoxyethoxy)propanamide
CID 119599208
N-(1-amino-2-methylpropan-2-yl)-4-pentoxybenzamide
CID 119524229
tert-butyl 2-heptoxypropanoate
CID 66337184
2-pentoxypropanamide
CID 62900296
methyl (2S)-2-hexoxypropanoate
CID 103337819
methyl 2-dodecoxypropanoate
CID 86244254
2-aminooxy-N-(2-methylbutan-2-yl)propanamide
CID 79426922

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride (CID 119524579) is N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride is CCCCOC(C)C(=O)NC(C)(C)CN.Cl.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride?
The InChIKey is FCKFLIRRRZPUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2.ClH/c1-5-6-7-15-9(2)10(14)13-11(3,4)8-12;/h9H,5-8,12H2,1-4H3,(H,13,14);1H.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride?
N-(1-amino-2-methylpropan-2-yl)-2-butoxypropanamide;hydrochloride has a molecular weight of 252.79 g/mol, XLogP of 1.47, 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-butoxypropanamide;hydrochloride is sourced from PubChem (CID 119524579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).