1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one

C16H19N3O2 — CID 43505471

IUPAC1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one
SMILESNCc1c(OCCN2CCNC2=O)ccc2ccccc12
InChIInChI=1S/C16H19N3O2/c17-11-14-13-4-2-1-3-12(13)5-6-15(14)21-10-9-19-8-7-18-16(19)20/h1-6H,7-11,17H2,(H,18,20)
InChIKeyYSSILRQPMFSQOS-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.70
Rot. Bonds5

About 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one

1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one (PubChem CID 43505471) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one
PubChem CID43505471
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one
SMILESNCc1c(OCCN2CCNC2=O)ccc2ccccc12
InChIInChI=1S/C16H19N3O2/c17-11-14-13-4-2-1-3-12(13)5-6-15(14)21-10-9-19-8-7-18-16(19)20/h1-6H,7-11,17H2,(H,18,20)
InChIKeyYSSILRQPMFSQOS-UHFFFAOYSA-N
XLogP1.70
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-3-[2-(7-methoxynaphthalen-1-yl)ethyl]urea
CID 9993398
1-[2-(7-Methoxynaphthalen-1-yl)ethyl]-3-propylurea
CID 22133298
1-(1,2-Dihydronaphtho[2,1-b]furyl}-N-hydroxyurea
CID 10752791
Urea, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-N'-(phenylmethyl)-
CID 3071648
10,11-Dihydro-7-oxa-10-aza-cyclohepta[a]naphthalen-9-one
CID 647130
(2-Ethoxy-naphthalen-1-ylmethyl)-(3-morpholin-4-yl-propyl)-amine
CID 56603483
CID 6603331
CID 6603331
(2-Allyloxy-naphthalen-1-ylmethyl)-(3-morpholin-4-yl-propyl)-amine
CID 11958702
CID 16192680
CID 16192680
(2-Methoxy-naphthalen-1-ylmethyl)-(2-morpholin-4-yl-ethyl)-amine
CID 23724345
[(2S,5S)-5-[(6-methoxynaphthalen-2-yl)methyl]oxolan-2-yl]methylurea
CID 42627840
2-[7-Methoxy-1-[2-(propanoylamino)ethyl]naphthalen-2-yl]oxyethyl-trimethylazanium iodide
CID 10390683

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one (CID 43505471) is 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one is NCc1c(OCCN2CCNC2=O)ccc2ccccc12.
What is the InChIKey of 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one?
The InChIKey is YSSILRQPMFSQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c17-11-14-13-4-2-1-3-12(13)5-6-15(14)21-10-9-19-8-7-18-16(19)20/h1-6H,7-11,17H2,(H,18,20).
What are the key properties of 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one?
1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one has a molecular weight of 285.35 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(aminomethyl)naphthalen-2-yl]oxyethyl]imidazolidin-2-one is sourced from PubChem (CID 43505471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).