N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide

C17H26N2O — CID 105060455

IUPACN-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide
SMILESCC(CN)(NC(=O)CCC1CCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-17(13-18,15-9-3-2-4-10-15)19-16(20)12-11-14-7-5-6-8-14/h2-4,9-10,14H,5-8,11-13,18H2,1H3,(H,19,20)
InChIKeySLMBUTHUNKEUQY-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.95
Rot. Bonds6

About N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide

N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide (PubChem CID 105060455) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide
PubChem CID105060455
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide
SMILESCC(CN)(NC(=O)CCC1CCCC1)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-17(13-18,15-9-3-2-4-10-15)19-16(20)12-11-14-7-5-6-8-14/h2-4,9-10,14H,5-8,11-13,18H2,1H3,(H,19,20)
InChIKeySLMBUTHUNKEUQY-UHFFFAOYSA-N
XLogP2.95
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide?
The IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide (CID 105060455) is N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide.
What is the SMILES notation for N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide?
The canonical SMILES for N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide is CC(CN)(NC(=O)CCC1CCCC1)c1ccccc1.
What is the InChIKey of N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide?
The InChIKey is SLMBUTHUNKEUQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-17(13-18,15-9-3-2-4-10-15)19-16(20)12-11-14-7-5-6-8-14/h2-4,9-10,14H,5-8,11-13,18H2,1H3,(H,19,20).
What are the key properties of N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide?
N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide is sourced from PubChem (CID 105060455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).