3-methyl-1-prop-1-en-2-ylpyrrolidine

C8H15N — CID 90249054

IUPAC3-methyl-1-prop-1-en-2-ylpyrrolidine
SMILESC=C(C)N1CCC(C)C1
InChIInChI=1S/C8H15N/c1-7(2)9-5-4-8(3)6-9/h8H,1,4-6H2,2-3H3
InChIKeyOWBRLPUYBYAQRM-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.86
Rot. Bonds1

About 3-methyl-1-prop-1-en-2-ylpyrrolidine

3-methyl-1-prop-1-en-2-ylpyrrolidine (PubChem CID 90249054) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 3-methyl-1-prop-1-en-2-ylpyrrolidine.

Molecular Properties

Compound Name3-methyl-1-prop-1-en-2-ylpyrrolidine
PubChem CID90249054
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name3-methyl-1-prop-1-en-2-ylpyrrolidine
SMILESC=C(C)N1CCC(C)C1
InChIInChI=1S/C8H15N/c1-7(2)9-5-4-8(3)6-9/h8H,1,4-6H2,2-3H3
InChIKeyOWBRLPUYBYAQRM-UHFFFAOYSA-N
XLogP1.86
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3-methyl-1-(3-methylpyrrolidin-1-yl)but-3-en-1-one
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ethane;3-methyl-1-(3-methylbut-1-en-2-yl)pyrrolidine
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4-chloro-1-prop-1-en-2-ylpiperidine
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1-[(3R)-3-methylpyrrolidin-1-yl]ethanimine
CID 59072020
3-methyl-N-(2-methylprop-2-enyl)pyrrolidine-1-carboxamide
CID 127013208
2-(1-prop-1-en-2-ylpyrrolidin-3-yl)acetic acid
CID 19705453
3-methyl-1-(1-prop-2-enoxyethenyl)pyrrolidine
CID 142201878
1-hept-1-en-2-yl-3-methylpyrrolidine
CID 89279754
3,3-difluoro-4-methyl-1-prop-1-en-2-ylpiperidine
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4-ethyl-1-prop-1-en-2-ylpiperidine
CID 142170735

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-prop-1-en-2-ylpyrrolidine?
The IUPAC name of 3-methyl-1-prop-1-en-2-ylpyrrolidine (CID 90249054) is 3-methyl-1-prop-1-en-2-ylpyrrolidine.
What is the SMILES notation for 3-methyl-1-prop-1-en-2-ylpyrrolidine?
The canonical SMILES for 3-methyl-1-prop-1-en-2-ylpyrrolidine is C=C(C)N1CCC(C)C1.
What is the InChIKey of 3-methyl-1-prop-1-en-2-ylpyrrolidine?
The InChIKey is OWBRLPUYBYAQRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-7(2)9-5-4-8(3)6-9/h8H,1,4-6H2,2-3H3.
What are the key properties of 3-methyl-1-prop-1-en-2-ylpyrrolidine?
3-methyl-1-prop-1-en-2-ylpyrrolidine has a molecular weight of 125.21 g/mol, XLogP of 1.86, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-prop-1-en-2-ylpyrrolidine is sourced from PubChem (CID 90249054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).