2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene

C19H22O — CID 168954401

IUPAC2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene
SMILESC/C=C/c1cccc(C(C)C)c1OCc1ccccc1
InChIInChI=1S/C19H22O/c1-4-9-17-12-8-13-18(15(2)3)19(17)20-14-16-10-6-5-7-11-16/h4-13,15H,14H2,1-3H3/b9-4+
InChIKeyGOCYANPZIMUKGE-RUDMXATFSA-N
MW266.38 g/mol
LogP5.42
Rot. Bonds5

About 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene

2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene (PubChem CID 168954401) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene.

Molecular Properties

Compound Name2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene
PubChem CID168954401
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene
SMILESC/C=C/c1cccc(C(C)C)c1OCc1ccccc1
InChIInChI=1S/C19H22O/c1-4-9-17-12-8-13-18(15(2)3)19(17)20-14-16-10-6-5-7-11-16/h4-13,15H,14H2,1-3H3/b9-4+
InChIKeyGOCYANPZIMUKGE-RUDMXATFSA-N
XLogP5.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.38
LogP ≤ 55.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-phenylmethoxy-3-prop-1-enylbenzaldehyde
CID 139673280
2-phenylmethoxy-3-prop-1-enylbenzoic acid
CID 71318162
1-(2-phenylmethoxy-3-propan-2-ylphenyl)ethanol
CID 170547313
(2S)-2-(2-phenylmethoxy-3-propan-2-ylphenyl)propanal
CID 141427213
1,3-dichloro-2-[2-phenylmethoxy-3-[(Z)-prop-1-enyl]phenyl]benzene
CID 69256865
1-cyclopropyl-1-(2-phenylmethoxy-3-propan-2-ylphenyl)ethanol
CID 141427218
1-ethoxy-3-[(E)-2-nitroethenyl]-2-phenylmethoxybenzene
CID 71624359
1-(3,3-dinitroprop-1-enyl)-3-methoxy-2-phenylmethoxybenzene
CID 173351121
methane;2-propan-2-yl-6-[(E)-prop-1-enyl]phenol;bis(2-[(E)-prop-1-enyl]phenol)
CID 167541647
bromomethane;N-[2-phenylmethoxy-6-[(Z)-prop-1-enyl]phenyl]formamide
CID 164875324
1,5-bis(prop-1-enyl)naphthalene
CID 139669430
potassium;3-methoxy-2-phenylmethoxybenzaldehyde;hydroxide
CID 160863194

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene?
The IUPAC name of 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene (CID 168954401) is 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene.
What is the SMILES notation for 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene?
The canonical SMILES for 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene is C/C=C/c1cccc(C(C)C)c1OCc1ccccc1.
What is the InChIKey of 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene?
The InChIKey is GOCYANPZIMUKGE-RUDMXATFSA-N. The full InChI is InChI=1S/C19H22O/c1-4-9-17-12-8-13-18(15(2)3)19(17)20-14-16-10-6-5-7-11-16/h4-13,15H,14H2,1-3H3/b9-4+.
What are the key properties of 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene?
2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene has a molecular weight of 266.38 g/mol, XLogP of 5.42, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-1-propan-2-yl-3-[(E)-prop-1-enyl]benzene is sourced from PubChem (CID 168954401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).