N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride

C10H23Cl2N3O — CID 86277381

IUPACN-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride
SMILESCN(C)CC(=O)NC1CCC(N)CC1.Cl.Cl
InChIInChI=1S/C10H21N3O.2ClH/c1-13(2)7-10(14)12-9-5-3-8(11)4-6-9;;/h8-9H,3-7,11H2,1-2H3,(H,12,14);2*1H
InChIKeyJYQLETFKTKSITP-UHFFFAOYSA-N
MW272.22 g/mol
LogP0.78
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride

N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride (PubChem CID 86277381) has the molecular formula C10H23Cl2N3O and a molecular weight of 272.22 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride
PubChem CID86277381
Molecular FormulaC10H23Cl2N3O
Molecular Weight272.22 g/mol
Exact Mass271.12
IUPAC NameN-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride
SMILESCN(C)CC(=O)NC1CCC(N)CC1.Cl.Cl
InChIInChI=1S/C10H21N3O.2ClH/c1-13(2)7-10(14)12-9-5-3-8(11)4-6-9;;/h8-9H,3-7,11H2,1-2H3,(H,12,14);2*1H
InChIKeyJYQLETFKTKSITP-UHFFFAOYSA-N
XLogP0.78
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.22
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;tert-butyl N-(4-aminocyclohexyl)carbamate;tert-butyl N-[4-[[2-(dimethylamino)acetyl]amino]cyclohexyl]carbamate
CID 161291088
2-(dimethylamino)-N-[4-(iodoamino)cyclohexyl]acetamide
CID 88963295
2-[(4-aminocyclohexyl)-methylamino]-N-cycloheptylacetamide
CID 79120936
N-(4-aminocyclohexyl)-3-(methylamino)propanamide
CID 62319076
2-(dimethylamino)-N-(3-propan-2-ylcyclopentyl)acetamide
CID 90085459
N-cyclopropyl-2-[methoxy(methyl)amino]acetamide
CID 131224480
2-(4-aminocyclohexyl)-N-(4-ethylcyclohexyl)acetamide
CID 62782919
N-(4-aminocyclohexyl)-2-(propan-2-ylamino)acetamide
CID 62319444
3-[[2-(cyclopropylamino)-2-oxoethyl]-methylamino]propanamide
CID 60700103
N-(4-aminocyclohexyl)-3-cyclopentylpropanamide;hydrochloride
CID 119260252
N-(4-aminocyclohexyl)-3-ethoxypropanamide;hydrochloride
CID 119475217
N-[2-[(4-aminocyclohexyl)amino]-2-oxoethyl]-N-methylthiophene-2-carboxamide
CID 119476525

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride (CID 86277381) is N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride is CN(C)CC(=O)NC1CCC(N)CC1.Cl.Cl.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride?
The InChIKey is JYQLETFKTKSITP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O.2ClH/c1-13(2)7-10(14)12-9-5-3-8(11)4-6-9;;/h8-9H,3-7,11H2,1-2H3,(H,12,14);2*1H.
What are the key properties of N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride?
N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride has a molecular weight of 272.22 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride is sourced from PubChem (CID 86277381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).