1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide

C12H25N3O — CID 79649570

IUPAC1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
SMILESCCN(CC(C)C)C1CCC(N)(C(N)=O)C1
InChIInChI=1S/C12H25N3O/c1-4-15(8-9(2)3)10-5-6-12(14,7-10)11(13)16/h9-10H,4-8,14H2,1-3H3,(H2,13,16)
InChIKeyZRNJWRZHLDDTKM-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.70
Rot. Bonds5

About 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide

1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide (PubChem CID 79649570) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
PubChem CID79649570
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide
SMILESCCN(CC(C)C)C1CCC(N)(C(N)=O)C1
InChIInChI=1S/C12H25N3O/c1-4-15(8-9(2)3)10-5-6-12(14,7-10)11(13)16/h9-10H,4-8,14H2,1-3H3,(H2,13,16)
InChIKeyZRNJWRZHLDDTKM-UHFFFAOYSA-N
XLogP0.70
TPSA72.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-amino-3-[ethyl(2-methylpropyl)amino]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

1-amino-3-[bis(3-methylbutyl)amino]cyclohexane-1-carboxamide
CID 107870991
1-amino-3-(dibutylamino)cyclopentane-1-carboxamide
CID 79649564
1-amino-3-[2-methylpropyl(propan-2-yl)amino]cyclohexane-1-carboxamide
CID 79641958
1-amino-3-[3,3-dimethylbutan-2-yl(methyl)amino]cyclopentane-1-carboxamide
CID 79655573
1-amino-3-[butan-2-yl(methyl)amino]cyclohexane-1-carboxamide
CID 79636285
1-amino-3-[methyl(2-methylpropyl)amino]cyclopentane-1-carboxylic acid
CID 79650269
1-amino-3-[butan-2-yl(ethyl)amino]cyclohexane-1-carboxamide
CID 79635988
methyl 1-amino-3-[2-methoxyethyl(2-methylpropyl)amino]cyclopentane-1-carboxylate
CID 79655290
3-[ethyl(2-methylpropyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxylic acid
CID 79650513
ethyl 1-(ethylamino)-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxylate
CID 79649720
3-[ethyl(2-ethylbutyl)amino]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79646901
1-amino-3-(3-methylbutylsulfanyl)cyclopentane-1-carboxamide
CID 107756277

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide (CID 79649570) is 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide is CCN(CC(C)C)C1CCC(N)(C(N)=O)C1.
What is the InChIKey of 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide?
The InChIKey is ZRNJWRZHLDDTKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-15(8-9(2)3)10-5-6-12(14,7-10)11(13)16/h9-10H,4-8,14H2,1-3H3,(H2,13,16).
What are the key properties of 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide?
1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide has a molecular weight of 227.35 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-[ethyl(2-methylpropyl)amino]cyclopentane-1-carboxamide is sourced from PubChem (CID 79649570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).