2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide

C15H27N3O2 — CID 62782563

IUPAC2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
SMILESNC(=O)CN(C(=O)CC1CCCC(N)C1)C1CCCC1
InChIInChI=1S/C15H27N3O2/c16-12-5-3-4-11(8-12)9-15(20)18(10-14(17)19)13-6-1-2-7-13/h11-13H,1-10,16H2,(H2,17,19)
InChIKeyJSBSFNZUEQGYJX-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.15
Rot. Bonds5

About 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide

2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide (PubChem CID 62782563) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
PubChem CID62782563
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
SMILESNC(=O)CN(C(=O)CC1CCCC(N)C1)C1CCCC1
InChIInChI=1S/C15H27N3O2/c16-12-5-3-4-11(8-12)9-15(20)18(10-14(17)19)13-6-1-2-7-13/h11-13H,1-10,16H2,(H2,17,19)
InChIKeyJSBSFNZUEQGYJX-UHFFFAOYSA-N
XLogP1.15
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-aminocyclohexyl)-methylamino]acetamide
CID 79467648
2-[(2-cyclohexylacetyl)-cyclopentylamino]acetic acid
CID 60826296
2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide
CID 106592765
N-(2-amino-2-oxoethyl)-N-cyclopentyl-4-hydroxybutanamide
CID 79204116
2-[1-(aminomethyl)cyclobutyl]-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
CID 81172433
2-(3-aminocyclohexyl)-N-butan-2-yl-N-methylacetamide
CID 62781673
2-(3-aminocyclohexyl)-N-[2-(ethylamino)-2-oxoethyl]-N-methylacetamide
CID 62781434
N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-(propan-2-ylamino)acetamide
CID 54871672
2-[(2-amino-2-oxoethyl)-(2-cyclobutylacetyl)amino]acetic acid
CID 107434388
4-amino-N-(2-amino-2-oxoethyl)-N-cyclopentylcyclopent-2-ene-1-carboxamide
CID 79210326
2-(3-aminocyclohexyl)-N-cyclooctylacetamide
CID 55116896
N-(4-aminocyclohexyl)-2-cyclohexyl-N-ethylacetamide
CID 79115417

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide?
The IUPAC name of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide (CID 62782563) is 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide?
The canonical SMILES for 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide is NC(=O)CN(C(=O)CC1CCCC(N)C1)C1CCCC1.
What is the InChIKey of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide?
The InChIKey is JSBSFNZUEQGYJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c16-12-5-3-4-11(8-12)9-15(20)18(10-14(17)19)13-6-1-2-7-13/h11-13H,1-10,16H2,(H2,17,19).
What are the key properties of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide?
2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide has a molecular weight of 281.40 g/mol, XLogP of 1.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide is sourced from PubChem (CID 62782563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).