2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide

C10H17N3O — CID 62743396

IUPAC2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCCC1C#N
InChIInChI=1S/C10H17N3O/c1-13(2)10(14)7-12-9-5-3-4-8(9)6-11/h8-9,12H,3-5,7H2,1-2H3
InChIKeyYDPCZPVPWSYCPW-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.36
Rot. Bonds3

About 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide

2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide (PubChem CID 62743396) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide
PubChem CID62743396
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1CCCC1C#N
InChIInChI=1S/C10H17N3O/c1-13(2)10(14)7-12-9-5-3-4-8(9)6-11/h8-9,12H,3-5,7H2,1-2H3
InChIKeyYDPCZPVPWSYCPW-UHFFFAOYSA-N
XLogP0.36
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide (CID 62743396) is 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide is CN(C)C(=O)CNC1CCCC1C#N.
What is the InChIKey of 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide?
The InChIKey is YDPCZPVPWSYCPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-13(2)10(14)7-12-9-5-3-4-8(9)6-11/h8-9,12H,3-5,7H2,1-2H3.
What are the key properties of 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide?
2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide has a molecular weight of 195.27 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-cyanocyclopentyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 62743396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).