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

C16H29N3O2 — CID 106592765

IUPAC2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide
SMILESCC(C(=O)N(CC(N)=O)C1CCCC1)C1CCCC(N)C1
InChIInChI=1S/C16H29N3O2/c1-11(12-5-4-6-13(17)9-12)16(21)19(10-15(18)20)14-7-2-3-8-14/h11-14H,2-10,17H2,1H3,(H2,18,20)
InChIKeyCZXVZRANJADDPI-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.40
Rot. Bonds5

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

2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide (PubChem CID 106592765) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide
PubChem CID106592765
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC Name2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide
SMILESCC(C(=O)N(CC(N)=O)C1CCCC1)C1CCCC(N)C1
InChIInChI=1S/C16H29N3O2/c1-11(12-5-4-6-13(17)9-12)16(21)19(10-15(18)20)14-7-2-3-8-14/h11-14H,2-10,17H2,1H3,(H2,18,20)
InChIKeyCZXVZRANJADDPI-UHFFFAOYSA-N
XLogP1.40
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminocyclohexyl)-N-cyclohexyl-N-ethylpropanamide
CID 106592635
2-(3-aminocyclohexyl)-N-(cyclopentylmethyl)-N-methylpropanamide
CID 106592908
2-(3-aminocyclohexyl)-N-(2,2-difluoroethyl)-N-methylpropanamide
CID 106593084
2-[(3-aminocyclohexyl)-methylamino]acetamide
CID 79467648
2-(3-aminocyclohexyl)-N,N-dibutylpropanamide
CID 106592670
N-(2-amino-2-oxoethyl)-N-cyclopentyl-2-methoxypropanamide
CID 47418493
2-(3-aminocyclohexyl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 106592776
2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
CID 62782563
2-(3-aminocyclohexyl)-N-cyclopentylpropanamide
CID 106592608
2-(3-aminocyclohexyl)-N-butyl-N-(2-hydroxyethyl)propanamide
CID 106592757
2-(3-aminocyclohexyl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide
CID 106592894
2-(3-aminocyclohexyl)-N-(2-hydroxyethyl)-N-(2-methoxyethyl)propanamide
CID 106593074

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide?
The IUPAC name of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide (CID 106592765) is 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide?
The canonical SMILES for 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide is CC(C(=O)N(CC(N)=O)C1CCCC1)C1CCCC(N)C1.
What is the InChIKey of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide?
The InChIKey is CZXVZRANJADDPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-11(12-5-4-6-13(17)9-12)16(21)19(10-15(18)20)14-7-2-3-8-14/h11-14H,2-10,17H2,1H3,(H2,18,20).
What are the key properties of 2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide?
2-(3-aminocyclohexyl)-N-(2-amino-2-oxoethyl)-N-cyclopentylpropanamide has a molecular weight of 295.43 g/mol, XLogP of 1.40, 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-cyclopentylpropanamide is sourced from PubChem (CID 106592765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).