CID 100937762

C16H19 — CID 100937762

IUPAC—
SMILES[c]1ccc(C23CC4CC(CC(C4)C2)C3)cc1
InChIInChI=1S/C16H19/c1-2-4-15(5-3-1)16-9-12-6-13(10-16)8-14(7-12)11-16/h2-5,12-14H,6-11H2
InChIKeyVVTJNUBAJPFROU-UHFFFAOYSA-N
MW211.33 g/mol
LogP3.95
Rot. Bonds1

About CID 100937762

CID 100937762 (PubChem CID 100937762) has the molecular formula C16H19 and a molecular weight of 211.33 g/mol.

Molecular Properties

Compound NameCID 100937762
PubChem CID100937762
Molecular FormulaC16H19
Molecular Weight211.33 g/mol
Exact Mass211.15
IUPAC Name—
SMILES[c]1ccc(C23CC4CC(CC(C4)C2)C3)cc1
InChIInChI=1S/C16H19/c1-2-4-15(5-3-1)16-9-12-6-13(10-16)8-14(7-12)11-16/h2-5,12-14H,6-11H2
InChIKeyVVTJNUBAJPFROU-UHFFFAOYSA-N
XLogP3.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[4-(1-adamantyl)phenyl]-phenyliodanium
CID 154594349
1-[4-[4-(4-tert-butylphenyl)phenyl]phenyl]adamantane
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2-[4-(1-adamantyl)phenyl]ethanamine
CID 14194658
1-[4-[[4-(1-adamantyl)phenyl]-diazomethyl]phenyl]adamantane
CID 137408787
4-(1-adamantyl)benzenesulfonic acid
CID 58030638
1-(4-phenylsulfanylphenyl)adamantane
CID 118102997
4-N-[4-(1-adamantyl)phenyl]benzene-1,4-diamine
CID 4764062
1-[3-(1-adamantyl)-5-methylphenyl]adamantane
CID 178165770
2,6-bis(1-adamantyl)phenol
CID 14169592
[4-(1-adamantyl)phenyl]-(4-iodophenyl)methanimine
CID 155003915
3-[4-(1-adamantyl)phenyl]prop-2-ynoic acid
CID 141276738
(1S)-1-[4-(1-adamantyl)phenyl]propan-1-amine
CID 97043066

Frequently Asked Questions

What is the IUPAC name of CID 100937762?
The IUPAC name of CID 100937762 (CID 100937762) is not available.
What is the SMILES notation for CID 100937762?
The canonical SMILES for CID 100937762 is [c]1ccc(C23CC4CC(CC(C4)C2)C3)cc1.
What is the InChIKey of CID 100937762?
The InChIKey is VVTJNUBAJPFROU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19/c1-2-4-15(5-3-1)16-9-12-6-13(10-16)8-14(7-12)11-16/h2-5,12-14H,6-11H2.
What are the key properties of CID 100937762?
CID 100937762 has a molecular weight of 211.33 g/mol, XLogP of 3.95, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 100937762 is sourced from PubChem (CID 100937762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).