2-(2-methylpropyl)-1-phenylpyrrolidine

C14H21N — CID 11241145

IUPAC2-(2-methylpropyl)-1-phenylpyrrolidine
SMILESCC(C)CC1CCCN1c1ccccc1
InChIInChI=1S/C14H21N/c1-12(2)11-14-9-6-10-15(14)13-7-4-3-5-8-13/h3-5,7-8,12,14H,6,9-11H2,1-2H3
InChIKeySXJRKUMIOGNBPJ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.70
Rot. Bonds3

About 2-(2-methylpropyl)-1-phenylpyrrolidine

2-(2-methylpropyl)-1-phenylpyrrolidine (PubChem CID 11241145) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-(2-methylpropyl)-1-phenylpyrrolidine.

Molecular Properties

Compound Name2-(2-methylpropyl)-1-phenylpyrrolidine
PubChem CID11241145
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-(2-methylpropyl)-1-phenylpyrrolidine
SMILESCC(C)CC1CCCN1c1ccccc1
InChIInChI=1S/C14H21N/c1-12(2)11-14-9-6-10-15(14)13-7-4-3-5-8-13/h3-5,7-8,12,14H,6,9-11H2,1-2H3
InChIKeySXJRKUMIOGNBPJ-UHFFFAOYSA-N
XLogP3.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1-phenylpyrrolidin-2-yl)methyl]propane-2-sulfonamide
CID 90619970
[(2R)-1-phenylpiperidin-2-yl]methanamine
CID 131023899
2-(2,3-dimethylbut-2-enyl)-1-phenylpyrrolidine
CID 101376496
1-phenyl-2-(2-phenylethyl)pyrrolidine
CID 10922989
N-benzyl-1-(1-phenylpyrrolidin-2-yl)methanamine
CID 3072413
2-chloro-4-[(2R)-2-(2-methylpropyl)pyrrolidin-1-yl]pyrimidine
CID 141444822
3-(1-phenylpyrrolidin-2-yl)propanoic acid
CID 117028652
trimethyl-[3-(1-phenylpyrrolidin-2-yl)prop-1-en-2-yl]silane
CID 135002130
3-methyl-1-(1-phenylpyrrolidin-2-yl)butan-1-one
CID 132966507
(2S)-1-phenylpyrrolidine-2-carbaldehyde
CID 173110062
N',N'-dimethyl-N-[(1-phenylpyrrolidin-2-yl)methyl]propane-1,3-diamine
CID 3072404
(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
CID 134966567

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-1-phenylpyrrolidine?
The IUPAC name of 2-(2-methylpropyl)-1-phenylpyrrolidine (CID 11241145) is 2-(2-methylpropyl)-1-phenylpyrrolidine.
What is the SMILES notation for 2-(2-methylpropyl)-1-phenylpyrrolidine?
The canonical SMILES for 2-(2-methylpropyl)-1-phenylpyrrolidine is CC(C)CC1CCCN1c1ccccc1.
What is the InChIKey of 2-(2-methylpropyl)-1-phenylpyrrolidine?
The InChIKey is SXJRKUMIOGNBPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-12(2)11-14-9-6-10-15(14)13-7-4-3-5-8-13/h3-5,7-8,12,14H,6,9-11H2,1-2H3.
What are the key properties of 2-(2-methylpropyl)-1-phenylpyrrolidine?
2-(2-methylpropyl)-1-phenylpyrrolidine has a molecular weight of 203.33 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-1-phenylpyrrolidine is sourced from PubChem (CID 11241145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).