2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide

C16H24N2O2 — CID 64824946

IUPAC2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCN(Cc1ccccc1)C(=O)C1CCCC1N
InChIInChI=1S/C16H24N2O2/c1-20-11-10-18(12-13-6-3-2-4-7-13)16(19)14-8-5-9-15(14)17/h2-4,6-7,14-15H,5,8-12,17H2,1H3
InChIKeyFJNXCWYVMSAAPI-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.79
Rot. Bonds6

About 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide

2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide (PubChem CID 64824946) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide
PubChem CID64824946
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCN(Cc1ccccc1)C(=O)C1CCCC1N
InChIInChI=1S/C16H24N2O2/c1-20-11-10-18(12-13-6-3-2-4-7-13)16(19)14-8-5-9-15(14)17/h2-4,6-7,14-15H,5,8-12,17H2,1H3
InChIKeyFJNXCWYVMSAAPI-UHFFFAOYSA-N
XLogP1.79
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide (CID 64824946) is 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide is COCCN(Cc1ccccc1)C(=O)C1CCCC1N.
What is the InChIKey of 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide?
The InChIKey is FJNXCWYVMSAAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-20-11-10-18(12-13-6-3-2-4-7-13)16(19)14-8-5-9-15(14)17/h2-4,6-7,14-15H,5,8-12,17H2,1H3.
What are the key properties of 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide?
2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-benzyl-N-(2-methoxyethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 64824946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).