3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide

C20H27N3O — CID 69061729

IUPAC3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide
SMILESCCN(CC)C1CN(C(=O)NCCc2cccc3ccccc23)C1
InChIInChI=1S/C20H27N3O/c1-3-22(4-2)18-14-23(15-18)20(24)21-13-12-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,18H,3-4,12-15H2,1-2H3,(H,21,24)
InChIKeyHRYQRDBPUCWXGC-UHFFFAOYSA-N
MW325.46 g/mol
LogP3.12
Rot. Bonds6

About 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide

3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide (PubChem CID 69061729) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide.

Molecular Properties

Compound Name3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide
PubChem CID69061729
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide
SMILESCCN(CC)C1CN(C(=O)NCCc2cccc3ccccc23)C1
InChIInChI=1S/C20H27N3O/c1-3-22(4-2)18-14-23(15-18)20(24)21-13-12-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,18H,3-4,12-15H2,1-2H3,(H,21,24)
InChIKeyHRYQRDBPUCWXGC-UHFFFAOYSA-N
XLogP3.12
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(ethylamino)-2-oxoethyl]-N-(2-naphthalen-1-ylethyl)piperazine-1-carboxamide
CID 38381542
ethyl N-[(3R)-1-(2-naphthalen-1-ylethylcarbamoyl)piperidin-3-yl]carbamate
CID 94112463
2-(2-fluorophenyl)-N-(2-naphthalen-1-ylethyl)morpholine-4-carboxamide
CID 102555836
2-hydroxy-N-(2-naphthalen-1-ylethyl)propanamide
CID 115140997
2-(1,3-dioxoisoindol-2-yl)-N-(2-naphthalen-1-ylethyl)propanamide
CID 2920554
2-(cyclopropylmethylamino)-N-(2-naphthalen-1-ylethyl)acetamide
CID 119722516
1-methyl-N-(2-naphthalen-1-ylethyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide
CID 166180094
2-hydroxy-2-methyl-N-(2-naphthalen-1-ylethyl)propanamide
CID 115178963
(2S)-2,4-dihydroxy-3,3-dimethyl-N-(2-naphthalen-1-ylethyl)butanamide
CID 125469777
N-(2-naphthalen-1-ylethyl)cyclohexanecarboxamide
CID 19963481
2-(cyclopropylmethylamino)-N-(2-naphthalen-1-ylethyl)acetamide;hydrochloride
CID 119722515
N-[2-(2-fluorophenyl)ethyl]-3,5-dimethylpiperidine-1-carboxamide
CID 108900039

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide?
The IUPAC name of 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide (CID 69061729) is 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide.
What is the SMILES notation for 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide?
The canonical SMILES for 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide is CCN(CC)C1CN(C(=O)NCCc2cccc3ccccc23)C1.
What is the InChIKey of 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide?
The InChIKey is HRYQRDBPUCWXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-3-22(4-2)18-14-23(15-18)20(24)21-13-12-17-10-7-9-16-8-5-6-11-19(16)17/h5-11,18H,3-4,12-15H2,1-2H3,(H,21,24).
What are the key properties of 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide?
3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide has a molecular weight of 325.46 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-N-(2-naphthalen-1-ylethyl)azetidine-1-carboxamide is sourced from PubChem (CID 69061729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).