2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide

C11H21N3O — CID 43137486

IUPAC2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide
SMILESNCCCN(CC(=O)NC1CC1)C1CC1
InChIInChI=1S/C11H21N3O/c12-6-1-7-14(10-4-5-10)8-11(15)13-9-2-3-9/h9-10H,1-8,12H2,(H,13,15)
InChIKeyVDQIKKYXNMVFSE-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.08
Rot. Bonds7

About 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide

2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide (PubChem CID 43137486) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide
PubChem CID43137486
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide
SMILESNCCCN(CC(=O)NC1CC1)C1CC1
InChIInChI=1S/C11H21N3O/c12-6-1-7-14(10-4-5-10)8-11(15)13-9-2-3-9/h9-10H,1-8,12H2,(H,13,15)
InChIKeyVDQIKKYXNMVFSE-UHFFFAOYSA-N
XLogP0.08
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-aminopropyl(cyclopropyl)amino]-N-cyclohexylacetamide
CID 43137540
2-[3-aminopropyl(cyclopentyl)amino]-N-cyclopentylacetamide
CID 43319618
2-[3-aminopropyl(cyclohexyl)amino]-N-cyclopentylacetamide
CID 43319655
2-[2-aminoethyl(cyclopropyl)amino]-N-cycloheptylacetamide
CID 62548939
2-[2-aminoethyl(cyclobutyl)amino]-N-cycloheptylacetamide
CID 102875096
2-[3-aminopropyl(cyclopentyl)amino]-N-methylacetamide
CID 43137553
2-[3-aminopropyl(cyclopentyl)amino]-N-propan-2-ylacetamide
CID 43137564
2-[cyclohexyl(2-hydroxyethyl)amino]-N-cyclopentylacetamide
CID 60694014
2-[3-aminopropyl(cyclopropyl)amino]-N-(2-methylphenyl)acetamide
CID 43319569
2-[3-aminopropyl(cycloheptyl)amino]-N-pentan-3-ylacetamide
CID 61487094
2-[3-aminopropyl(cycloheptyl)amino]-N-butan-2-ylacetamide
CID 43137666
2-[2-aminoethyl(ethyl)amino]-N-cyclopropylacetamide
CID 61349324

Frequently Asked Questions

What is the IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide (CID 43137486) is 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide is NCCCN(CC(=O)NC1CC1)C1CC1.
What is the InChIKey of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide?
The InChIKey is VDQIKKYXNMVFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c12-6-1-7-14(10-4-5-10)8-11(15)13-9-2-3-9/h9-10H,1-8,12H2,(H,13,15).
What are the key properties of 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide?
2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide has a molecular weight of 211.31 g/mol, XLogP of 0.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-aminopropyl(cyclopropyl)amino]-N-cyclopropylacetamide is sourced from PubChem (CID 43137486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).