N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide

C21H28N2O2 — CID 120597733

IUPACN-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCC1(C(=O)NC(CN)c2ccc3ccccc3c2)CCCC1
InChIInChI=1S/C21H28N2O2/c1-25-13-12-21(10-4-5-11-21)20(24)23-19(15-22)18-9-8-16-6-2-3-7-17(16)14-18/h2-3,6-9,14,19H,4-5,10-13,15,22H2,1H3,(H,23,24)
InChIKeyAMBUOHLVQNURTP-UHFFFAOYSA-N
MW340.47 g/mol
LogP3.55
Rot. Bonds7

About N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide

N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide (PubChem CID 120597733) has the molecular formula C21H28N2O2 and a molecular weight of 340.47 g/mol. Its IUPAC name is N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide
PubChem CID120597733
Molecular FormulaC21H28N2O2
Molecular Weight340.47 g/mol
Exact Mass340.22
IUPAC NameN-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide
SMILESCOCCC1(C(=O)NC(CN)c2ccc3ccccc3c2)CCCC1
InChIInChI=1S/C21H28N2O2/c1-25-13-12-21(10-4-5-11-21)20(24)23-19(15-22)18-9-8-16-6-2-3-7-17(16)14-18/h2-3,6-9,14,19H,4-5,10-13,15,22H2,1H3,(H,23,24)
InChIKeyAMBUOHLVQNURTP-UHFFFAOYSA-N
XLogP3.55
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-2-hydroxy-1-phenylethyl]-1-(2-methoxyethyl)cyclopentane-1-carboxamide
CID 110001954
N-(2-amino-1-naphthalen-2-ylethyl)-4-(3-methoxypropoxy)benzamide;hydrochloride
CID 120567754
3-amino-N-(2-amino-1-naphthalen-2-ylethyl)propanamide
CID 122081221
N-(2-amino-1-naphthalen-2-ylethyl)-3-methylbutanamide
CID 120567667
N-(2-amino-1-naphthalen-2-ylethyl)-4-(3-fluorophenyl)oxane-4-carboxamide;hydrochloride
CID 120597788
(2S)-N-(2-amino-1-naphthalen-2-ylethyl)-5-oxopyrrolidine-2-carboxamide;hydrochloride
CID 120567464
N-(2-amino-1-naphthalen-2-ylethyl)-2-(2-oxoazocan-1-yl)acetamide
CID 120567789
2-[2-amino-1-[bis(2-methoxyethyl)sulfamoylamino]ethyl]naphthalene
CID 120584385
N-(2-amino-1-naphthalen-2-ylethyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide;hydrochloride
CID 120568008
(3-methoxy-1-naphthalen-2-ylpropyl)hydrazine
CID 105206319
N-[(1R)-2-amino-1-naphthalen-2-ylethyl]-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 170899336
1-N-(2-amino-1-naphthalen-2-ylethyl)cyclohexane-1,3-dicarboxamide
CID 167749206

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The IUPAC name of N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide (CID 120597733) is N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The canonical SMILES for N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide is COCCC1(C(=O)NC(CN)c2ccc3ccccc3c2)CCCC1.
What is the InChIKey of N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
The InChIKey is AMBUOHLVQNURTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O2/c1-25-13-12-21(10-4-5-11-21)20(24)23-19(15-22)18-9-8-16-6-2-3-7-17(16)14-18/h2-3,6-9,14,19H,4-5,10-13,15,22H2,1H3,(H,23,24).
What are the key properties of N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide?
N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide has a molecular weight of 340.47 g/mol, XLogP of 3.55, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-naphthalen-2-ylethyl)-1-(2-methoxyethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 120597733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).