3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide

C11H21N3O — CID 79462547

IUPAC3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide
SMILESNC1CCC(NCCC(=O)NC2CC2)C1
InChIInChI=1S/C11H21N3O/c12-8-1-2-10(7-8)13-6-5-11(15)14-9-3-4-9/h8-10,13H,1-7,12H2,(H,14,15)
InChIKeyRTSRABLKKXPCTC-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.12
Rot. Bonds5

About 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide

3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide (PubChem CID 79462547) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide
PubChem CID79462547
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide
SMILESNC1CCC(NCCC(=O)NC2CC2)C1
InChIInChI=1S/C11H21N3O/c12-8-1-2-10(7-8)13-6-5-11(15)14-9-3-4-9/h8-10,13H,1-7,12H2,(H,14,15)
InChIKeyRTSRABLKKXPCTC-UHFFFAOYSA-N
XLogP0.12
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide?
The IUPAC name of 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide (CID 79462547) is 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide.
What is the SMILES notation for 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide?
The canonical SMILES for 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide is NC1CCC(NCCC(=O)NC2CC2)C1.
What is the InChIKey of 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide?
The InChIKey is RTSRABLKKXPCTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c12-8-1-2-10(7-8)13-6-5-11(15)14-9-3-4-9/h8-10,13H,1-7,12H2,(H,14,15).
What are the key properties of 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide?
3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide has a molecular weight of 211.31 g/mol, XLogP of 0.12, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-aminocyclopentyl)amino]-N-cyclopropylpropanamide is sourced from PubChem (CID 79462547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).