argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene

C35H40Ar3N2 — CID 159667815

IUPACargon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene
SMILESCC.CCn1c2ccccc2c2cc3ccccc3cc21.CN1CCCC1.[Ar].[Ar].[Ar].c1ccc2ccccc2c1
InChIInChI=1S/C18H15N.C10H8.C5H11N.C2H6.3Ar/c1-2-19-17-10-6-5-9-15(17)16-11-13-7-3-4-8-14(13)12-18(16)19;1-2-6-10-8-4-3-7-9(10)5-1;1-6-4-2-3-5-6;1-2;;;/h3-12H,2H2,1H3;1-8H;2-5H2,1H3;1-2H3;;;
InChIKeyMTQDRTPDVMLQPY-UHFFFAOYSA-N
MW608.56 g/mol
LogP9.55
Rot. Bonds1

About argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene

argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene (PubChem CID 159667815) has the molecular formula C35H40Ar3N2 and a molecular weight of 608.56 g/mol. Its IUPAC name is argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene.

Molecular Properties

Compound Nameargon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene
PubChem CID159667815
Molecular FormulaC35H40Ar3N2
Molecular Weight608.56 g/mol
Exact Mass608.21
IUPAC Nameargon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene
SMILESCC.CCn1c2ccccc2c2cc3ccccc3cc21.CN1CCCC1.[Ar].[Ar].[Ar].c1ccc2ccccc2c1
InChIInChI=1S/C18H15N.C10H8.C5H11N.C2H6.3Ar/c1-2-19-17-10-6-5-9-15(17)16-11-13-7-3-4-8-14(13)12-18(16)19;1-2-6-10-8-4-3-7-9(10)5-1;1-6-4-2-3-5-6;1-2;;;/h3-12H,2H2,1H3;1-8H;2-5H2,1H3;1-2H3;;;
InChIKeyMTQDRTPDVMLQPY-UHFFFAOYSA-N
XLogP9.55
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500608.56
LogP ≤ 59.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene?
The IUPAC name of argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene (CID 159667815) is argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene.
What is the SMILES notation for argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene?
The canonical SMILES for argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene is CC.CCn1c2ccccc2c2cc3ccccc3cc21.CN1CCCC1.[Ar].[Ar].[Ar].c1ccc2ccccc2c1.
What is the InChIKey of argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene?
The InChIKey is MTQDRTPDVMLQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N.C10H8.C5H11N.C2H6.3Ar/c1-2-19-17-10-6-5-9-15(17)16-11-13-7-3-4-8-14(13)12-18(16)19;1-2-6-10-8-4-3-7-9(10)5-1;1-6-4-2-3-5-6;1-2;;;/h3-12H,2H2,1H3;1-8H;2-5H2,1H3;1-2H3;;;.
What are the key properties of argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene?
argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene has a molecular weight of 608.56 g/mol, XLogP of 9.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for argon;ethane;5-ethylbenzo[b]carbazole;1-methylpyrrolidine;naphthalene is sourced from PubChem (CID 159667815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).