cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid

C14H25N3O3 — CID 106320224

IUPACcis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid
SMILESCN(C)C1(CNC(=O)N[C@H]2CC[C@@H](C(=O)O)C2)CCC1
InChIInChI=1S/C14H25N3O3/c1-17(2)14(6-3-7-14)9-15-13(20)16-11-5-4-10(8-11)12(18)19/h10-11H,3-9H2,1-2H3,(H,18,19)(H2,15,16,20)/t10-,11+/m1/s1
InChIKeyVXFBMCCOTWYFEZ-MNOVXSKESA-N
MW283.37 g/mol
LogP1.02
Rot. Bonds5

About cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid

cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid (PubChem CID 106320224) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Namecis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid
PubChem CID106320224
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC Namecis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid
SMILESCN(C)C1(CNC(=O)N[C@H]2CC[C@@H](C(=O)O)C2)CCC1
InChIInChI=1S/C14H25N3O3/c1-17(2)14(6-3-7-14)9-15-13(20)16-11-5-4-10(8-11)12(18)19/h10-11H,3-9H2,1-2H3,(H,18,19)(H2,15,16,20)/t10-,11+/m1/s1
InChIKeyVXFBMCCOTWYFEZ-MNOVXSKESA-N
XLogP1.02
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid?
The IUPAC name of cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid (CID 106320224) is cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid?
The canonical SMILES for cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid is CN(C)C1(CNC(=O)N[C@H]2CC[C@@H](C(=O)O)C2)CCC1.
What is the InChIKey of cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid?
The InChIKey is VXFBMCCOTWYFEZ-MNOVXSKESA-N. The full InChI is InChI=1S/C14H25N3O3/c1-17(2)14(6-3-7-14)9-15-13(20)16-11-5-4-10(8-11)12(18)19/h10-11H,3-9H2,1-2H3,(H,18,19)(H2,15,16,20)/t10-,11+/m1/s1.
What are the key properties of cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid?
cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid has a molecular weight of 283.37 g/mol, XLogP of 1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-[[1-(dimethylamino)cyclobutyl]methylcarbamoylamino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 106320224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).