2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide

C16H25N3O — CID 63761281

IUPAC2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
SMILESCC(C(=O)Nc1ccccc1)N(CCN)C1CCCC1
InChIInChI=1S/C16H25N3O/c1-13(16(20)18-14-7-3-2-4-8-14)19(12-11-17)15-9-5-6-10-15/h2-4,7-8,13,15H,5-6,9-12,17H2,1H3,(H,18,20)
InChIKeyRITHOJMOUBXIBB-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.22
Rot. Bonds6

About 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide

2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide (PubChem CID 63761281) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
PubChem CID63761281
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide
SMILESCC(C(=O)Nc1ccccc1)N(CCN)C1CCCC1
InChIInChI=1S/C16H25N3O/c1-13(16(20)18-14-7-3-2-4-8-14)19(12-11-17)15-9-5-6-10-15/h2-4,7-8,13,15H,5-6,9-12,17H2,1H3,(H,18,20)
InChIKeyRITHOJMOUBXIBB-UHFFFAOYSA-N
XLogP2.22
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclobutyl(3-hydroxypropyl)amino]-N-phenylpropanamide
CID 102858396
2-[2-aminoethyl(cyclobutyl)amino]-N-cyclohexylpropanamide
CID 102875118
1-(3-aminopropyl)-1-cyclopentyl-3-phenylurea
CID 43319508
N-[3-(aminomethyl)phenyl]-2-[cyclopropyl(propyl)amino]propanamide
CID 43270105
2-[2-aminoethyl(cyclopentyl)amino]-N-(ethylcarbamoyl)propanamide
CID 63761474
N-(3-aminophenyl)-2-[cyclopropyl(3-methylbutyl)amino]propanamide
CID 78973756
2-[2-aminoethyl(cyclopentyl)amino]-N-(2-methylbutan-2-yl)propanamide
CID 63760066
2-[2-aminoethyl(2,2-difluoroethyl)amino]-N-phenylpropanamide
CID 107494405
N-(2-aminophenyl)-2-[cyclopropyl(propyl)amino]propanamide
CID 43270011
2-[3-aminopropyl(cyclobutyl)amino]-N-propan-2-ylpropanamide
CID 102875071
2-[(2-amino-1-cyclopropylethyl)-methylamino]-N-phenylpropanamide
CID 116653105
N-(4-aminophenyl)-2-[cyclopropyl(2-methoxyethyl)amino]propanamide
CID 61450272

Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide?
The IUPAC name of 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide (CID 63761281) is 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide.
What is the SMILES notation for 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide?
The canonical SMILES for 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide is CC(C(=O)Nc1ccccc1)N(CCN)C1CCCC1.
What is the InChIKey of 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide?
The InChIKey is RITHOJMOUBXIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-13(16(20)18-14-7-3-2-4-8-14)19(12-11-17)15-9-5-6-10-15/h2-4,7-8,13,15H,5-6,9-12,17H2,1H3,(H,18,20).
What are the key properties of 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide?
2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide has a molecular weight of 275.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethyl(cyclopentyl)amino]-N-phenylpropanamide is sourced from PubChem (CID 63761281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).