N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride

C13H26ClN3O — CID 119922828

IUPACN-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
SMILESCN(CC(=O)NC1CCCCC1)C1CCNC1.Cl
InChIInChI=1S/C13H25N3O.ClH/c1-16(12-7-8-14-9-12)10-13(17)15-11-5-3-2-4-6-11;/h11-12,14H,2-10H2,1H3,(H,15,17);1H
InChIKeyIOWJBHYNNHCJPV-UHFFFAOYSA-N
MW275.82 g/mol
LogP1.15
Rot. Bonds4

About N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride

N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride (PubChem CID 119922828) has the molecular formula C13H26ClN3O and a molecular weight of 275.82 g/mol. Its IUPAC name is N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
PubChem CID119922828
Molecular FormulaC13H26ClN3O
Molecular Weight275.82 g/mol
Exact Mass275.18
IUPAC NameN-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
SMILESCN(CC(=O)NC1CCCCC1)C1CCNC1.Cl
InChIInChI=1S/C13H25N3O.ClH/c1-16(12-7-8-14-9-12)10-13(17)15-11-5-3-2-4-6-11;/h11-12,14H,2-10H2,1H3,(H,15,17);1H
InChIKeyIOWJBHYNNHCJPV-UHFFFAOYSA-N
XLogP1.15
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.82
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-2-[methyl(piperidin-3-yl)amino]acetamide
CID 63644075
N-(4-methylcyclohexyl)-2-[methyl(piperidin-3-yl)amino]acetamide
CID 55249118
3-cyclohexyl-1-methyl-1-pyrrolidin-3-ylurea
CID 60805183
N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933007
N-cyclohexyl-N-ethyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119923071
N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 63304196
2-[(4-aminocyclohexyl)-methylamino]-N-cycloheptylacetamide
CID 79120936
1-(azepan-1-yl)-2-[methyl(pyrrolidin-3-yl)amino]ethanone;hydrochloride
CID 119922846
N-(cyclopropylcarbamoyl)-2-[methyl(piperidin-4-yl)amino]acetamide;hydrochloride
CID 119913095
N-(2-acetamidoethyl)-2-[methyl(pyrrolidin-3-yl)amino]acetamide
CID 63301776
N-cyclohexyl-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636311
4-[(2-cyclohexylacetyl)amino]-N-methyl-N-pyrrolidin-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119552192

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The IUPAC name of N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride (CID 119922828) is N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride is CN(CC(=O)NC1CCCCC1)C1CCNC1.Cl.
What is the InChIKey of N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
The InChIKey is IOWJBHYNNHCJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O.ClH/c1-16(12-7-8-14-9-12)10-13(17)15-11-5-3-2-4-6-11;/h11-12,14H,2-10H2,1H3,(H,15,17);1H.
What are the key properties of N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride?
N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride has a molecular weight of 275.82 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119922828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).