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

C12H23N3O2 — CID 66010622

IUPAC3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
SMILESCC(C)NC(=O)CN(C)C(=O)C1CCC(N)C1
InChIInChI=1S/C12H23N3O2/c1-8(2)14-11(16)7-15(3)12(17)9-4-5-10(13)6-9/h8-10H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyJHTOWASCNAXHOF-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.10
Rot. Bonds4

About 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide

3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide (PubChem CID 66010622) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
PubChem CID66010622
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide
SMILESCC(C)NC(=O)CN(C)C(=O)C1CCC(N)C1
InChIInChI=1S/C12H23N3O2/c1-8(2)14-11(16)7-15(3)12(17)9-4-5-10(13)6-9/h8-10H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyJHTOWASCNAXHOF-UHFFFAOYSA-N
XLogP0.10
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 62775426
3-amino-N-(2-hydroxypropyl)-N-methylcyclopentane-1-carboxamide
CID 66007556
N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119272093
4-amino-N-methyl-N-[2-(methylamino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 60846741
3-amino-N-[2-(diethylamino)-2-oxoethyl]-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119686528
3-amino-N-methyl-N-propylcyclopentane-1-carboxamide
CID 66031475
3-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 114949026
4-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]oxolane-3-carboxamide
CID 66240452
4-amino-N-ethyl-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclohexane-1-carboxamide
CID 62783394
2-[(3-aminocyclohexyl)-ethylamino]-N-propan-2-ylacetamide
CID 79468061
3-amino-N-methyl-N-[2-methyl-3-(methylamino)-3-oxopropyl]cyclohexane-1-carboxamide
CID 113267257
3-amino-N-(1-cyclopropylethyl)-N-methylcyclopentane-1-carboxamide
CID 66032087

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide (CID 66010622) is 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide is CC(C)NC(=O)CN(C)C(=O)C1CCC(N)C1.
What is the InChIKey of 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
The InChIKey is JHTOWASCNAXHOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-8(2)14-11(16)7-15(3)12(17)9-4-5-10(13)6-9/h8-10H,4-7,13H2,1-3H3,(H,14,16).
What are the key properties of 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide?
3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 66010622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).