1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine

C15H21N — CID 143603127

IUPAC1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine
SMILESC/C=C\c1c(C)cccc1CN1CCCC1
InChIInChI=1S/C15H21N/c1-3-7-15-13(2)8-6-9-14(15)12-16-10-4-5-11-16/h3,6-9H,4-5,10-12H2,1-2H3/b7-3-
InChIKeyLPXQYZPEOUQOCQ-CLTKARDFSA-N
MW215.34 g/mol
LogP3.62
Rot. Bonds3

About 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine

1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine (PubChem CID 143603127) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine.

Molecular Properties

Compound Name1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine
PubChem CID143603127
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine
SMILESC/C=C\c1c(C)cccc1CN1CCCC1
InChIInChI=1S/C15H21N/c1-3-7-15-13(2)8-6-9-14(15)12-16-10-4-5-11-16/h3,6-9H,4-5,10-12H2,1-2H3/b7-3-
InChIKeyLPXQYZPEOUQOCQ-CLTKARDFSA-N
XLogP3.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 166756979
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2-methyl-6-[[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methyl]phenol
CID 115903837
N-[[2-(azetidin-1-ylmethyl)-6-chlorophenyl]methylidene]hydroxylamine
CID 154024589
N-(2,6-dimethylphenyl)-2-(pyrrolidin-1-ylmethyl)benzamide
CID 12806258
1-[(2,3-dichlorophenyl)methyl]azetidine
CID 131042479
2-[2-formyl-6-(pyrrolidin-1-ylmethyl)phenyl]-3-(pyrrolidin-1-ylmethyl)benzaldehyde
CID 141487632
N-(2,6-dimethylphenyl)-2-(piperidin-1-ylmethyl)benzamide;hydrochloride
CID 12806265
1-[(2-chlorophenyl)methyl]azepane
CID 17017924
2-(pyrrolidin-1-ylmethyl)benzenethiol
CID 46785608
1-[(3-methylazulen-1-yl)methyl]piperidine
CID 101178026

Frequently Asked Questions

What is the IUPAC name of 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine?
The IUPAC name of 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine (CID 143603127) is 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine.
What is the SMILES notation for 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine?
The canonical SMILES for 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine is C/C=C\c1c(C)cccc1CN1CCCC1.
What is the InChIKey of 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine?
The InChIKey is LPXQYZPEOUQOCQ-CLTKARDFSA-N. The full InChI is InChI=1S/C15H21N/c1-3-7-15-13(2)8-6-9-14(15)12-16-10-4-5-11-16/h3,6-9H,4-5,10-12H2,1-2H3/b7-3-.
What are the key properties of 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine?
1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine has a molecular weight of 215.34 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[3-methyl-2-[(Z)-prop-1-enyl]phenyl]methyl]pyrrolidine is sourced from PubChem (CID 143603127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).