2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide

C13H25N3O2 — CID 64824749

IUPAC2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)C1CCCC1N
InChIInChI=1S/C13H25N3O2/c1-4-16(8-12(17)15-9(2)3)13(18)10-6-5-7-11(10)14/h9-11H,4-8,14H2,1-3H3,(H,15,17)
InChIKeyBGHNUDDPMYWFFZ-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.49
Rot. Bonds5

About 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide

2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide (PubChem CID 64824749) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
PubChem CID64824749
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
SMILESCCN(CC(=O)NC(C)C)C(=O)C1CCCC1N
InChIInChI=1S/C13H25N3O2/c1-4-16(8-12(17)15-9(2)3)13(18)10-6-5-7-11(10)14/h9-11H,4-8,14H2,1-3H3,(H,15,17)
InChIKeyBGHNUDDPMYWFFZ-UHFFFAOYSA-N
XLogP0.49
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]cyclopentane-1-carboxamide
CID 64825146
4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
CID 62783394
3-amino-N,N-diethyl-2-methylcyclohexane-1-carboxamide
CID 62777725
2-amino-N-ethyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 64824092
2-amino-N-ethyl-N-propylcyclohexane-1-carboxamide
CID 62777516
2-[carbamoyl(ethyl)amino]-N-propan-2-ylacetamide
CID 60703127
3-amino-N-ethyl-2-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 113416182
2-(3-aminocyclohexyl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 106592776
cis-(1R,2S)-2-amino-N-propan-2-ylcyclopentane-1-carboxamide
CID 67437509
2-(3-aminoazetidin-1-yl)-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 65249916
N-ethyl-6-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide
CID 54985906
ethyl N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]carbamate
CID 60652174

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide (CID 64824749) is 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide is CCN(CC(=O)NC(C)C)C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The InChIKey is BGHNUDDPMYWFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-16(8-12(17)15-9(2)3)13(18)10-6-5-7-11(10)14/h9-11H,4-8,14H2,1-3H3,(H,15,17).
What are the key properties of 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64824749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).