CID 102445738

C15H19 — CID 102445738

IUPAC—
SMILES[CH](C1CCCC1)[C@@H]1C[C@H]1c1ccccc1
InChIInChI=1S/C15H19/c1-2-8-13(9-3-1)15-11-14(15)10-12-6-4-5-7-12/h1-3,8-10,12,14-15H,4-7,11H2/t14-,15+/m1/s1
InChIKeyBBBYPEFZLUYOAP-CABCVRRESA-N
MW199.32 g/mol
LogP4.18
Rot. Bonds3

About CID 102445738

CID 102445738 (PubChem CID 102445738) has the molecular formula C15H19 and a molecular weight of 199.32 g/mol.

Molecular Properties

Compound NameCID 102445738
PubChem CID102445738
Molecular FormulaC15H19
Molecular Weight199.32 g/mol
Exact Mass199.15
IUPAC Name—
SMILES[CH](C1CCCC1)[C@@H]1C[C@H]1c1ccccc1
InChIInChI=1S/C15H19/c1-2-8-13(9-3-1)15-11-14(15)10-12-6-4-5-7-12/h1-3,8-10,12,14-15H,4-7,11H2/t14-,15+/m1/s1
InChIKeyBBBYPEFZLUYOAP-CABCVRRESA-N
XLogP4.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(1S,2R)-2-prop-2-enylcyclohexyl]benzene
CID 101198941
[(1R,2R)-2-(chloromethyl)cyclohexyl]benzene
CID 130762341
cyclohexyl(phenyl)iodanium
CID 87308360
trans-(1S,2R)-2-phenylcyclohexan-1-amine;hydrochloride
CID 21128019
1-bromo-2-phenylcycloheptane
CID 63510810
[(1R,2S)-2-phenylcyclohexyl] carbonochloridate
CID 15691294
(1S)-3-phenylcyclohexane-1-carbaldehyde
CID 57073826
8-phenylbicyclo[5.2.0]non-1-ene
CID 134982556
cyclopentylbenzene;iron
CID 158512704
1-chloro-4-(2-phenylcyclopropyl)benzene
CID 5162571
2-phenylcycloheptane-1-carbaldehyde;prop-2-enal
CID 87968076
(2-phenylcyclohexyl) formate
CID 87286934

Frequently Asked Questions

What is the IUPAC name of CID 102445738?
The IUPAC name of CID 102445738 (CID 102445738) is not available.
What is the SMILES notation for CID 102445738?
The canonical SMILES for CID 102445738 is [CH](C1CCCC1)[C@@H]1C[C@H]1c1ccccc1.
What is the InChIKey of CID 102445738?
The InChIKey is BBBYPEFZLUYOAP-CABCVRRESA-N. The full InChI is InChI=1S/C15H19/c1-2-8-13(9-3-1)15-11-14(15)10-12-6-4-5-7-12/h1-3,8-10,12,14-15H,4-7,11H2/t14-,15+/m1/s1.
What are the key properties of CID 102445738?
CID 102445738 has a molecular weight of 199.32 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102445738 is sourced from PubChem (CID 102445738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).