N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride

C10H24ClN3O — CID 120704264

IUPACN-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride
SMILESCCC(C)N(C)CCNC(=O)CNC.Cl
InChIInChI=1S/C10H23N3O.ClH/c1-5-9(2)13(4)7-6-12-10(14)8-11-3;/h9,11H,5-8H2,1-4H3,(H,12,14);1H
InChIKeyZUYGAIPLYWPJNB-UHFFFAOYSA-N
MW237.77 g/mol
LogP0.47
Rot. Bonds7

About N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride

N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride (PubChem CID 120704264) has the molecular formula C10H24ClN3O and a molecular weight of 237.77 g/mol. Its IUPAC name is N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride
PubChem CID120704264
Molecular FormulaC10H24ClN3O
Molecular Weight237.77 g/mol
Exact Mass237.16
IUPAC NameN-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride
SMILESCCC(C)N(C)CCNC(=O)CNC.Cl
InChIInChI=1S/C10H23N3O.ClH/c1-5-9(2)13(4)7-6-12-10(14)8-11-3;/h9,11H,5-8H2,1-4H3,(H,12,14);1H
InChIKeyZUYGAIPLYWPJNB-UHFFFAOYSA-N
XLogP0.47
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-anilino-N-[2-[butan-2-yl(methyl)amino]ethyl]acetamide;dihydrochloride
CID 119874299
4-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]butanamide;dihydrochloride
CID 119874323
3-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]-4-methylpentanamide
CID 107143404
(2S)-2-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]propanamide
CID 103814253
3-(aminomethyl)-N-[2-[butan-2-yl(methyl)amino]ethyl]pentanamide
CID 114134084
2-(aminomethyl)-N-[2-[butan-2-yl(methyl)amino]ethyl]-3-methylbutanamide
CID 107269526
N-ethyl-2-(methylamino)acetamide;hydrochloride
CID 18526161
2-(methylamino)-N-[4-[[2-(methylamino)acetyl]amino]butyl]acetamide
CID 177413313
(2S)-2-amino-N-[2-[butan-2-yl(methyl)amino]ethyl]hexanamide
CID 103832053
2-[2-[butan-2-yl(methyl)amino]ethylcarbamoyl-propan-2-ylamino]acetic acid
CID 114134222
2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
CID 62642701
N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 56823979

Frequently Asked Questions

What is the IUPAC name of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride (CID 120704264) is N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride is CCC(C)N(C)CCNC(=O)CNC.Cl.
What is the InChIKey of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride?
The InChIKey is ZUYGAIPLYWPJNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O.ClH/c1-5-9(2)13(4)7-6-12-10(14)8-11-3;/h9,11H,5-8H2,1-4H3,(H,12,14);1H.
What are the key properties of N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride?
N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride has a molecular weight of 237.77 g/mol, XLogP of 0.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butan-2-yl(methyl)amino]ethyl]-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 120704264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).