(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide

C16H24N2O2 — CID 78985362

IUPAC(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C16H24N2O2/c17-15(12-13-6-2-1-3-7-13)16(20)18(10-11-19)14-8-4-5-9-14/h1-3,6-7,14-15,19H,4-5,8-12,17H2/t15-/m1/s1
InChIKeyCAJQRRSUFZXNEF-OAHLLOKOSA-N
MW276.38 g/mol
LogP1.32
Rot. Bonds6

About (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide

(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide (PubChem CID 78985362) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide
PubChem CID78985362
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide
SMILESN[C@H](Cc1ccccc1)C(=O)N(CCO)C1CCCC1
InChIInChI=1S/C16H24N2O2/c17-15(12-13-6-2-1-3-7-13)16(20)18(10-11-19)14-8-4-5-9-14/h1-3,6-7,14-15,19H,4-5,8-12,17H2/t15-/m1/s1
InChIKeyCAJQRRSUFZXNEF-OAHLLOKOSA-N
XLogP1.32
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide (CID 78985362) is (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide is N[C@H](Cc1ccccc1)C(=O)N(CCO)C1CCCC1.
What is the InChIKey of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide?
The InChIKey is CAJQRRSUFZXNEF-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H24N2O2/c17-15(12-13-6-2-1-3-7-13)16(20)18(10-11-19)14-8-4-5-9-14/h1-3,6-7,14-15,19H,4-5,8-12,17H2/t15-/m1/s1.
What are the key properties of (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide?
(2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide has a molecular weight of 276.38 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-phenylpropanamide is sourced from PubChem (CID 78985362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).