2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine

C16H23N — CID 167249235

IUPAC2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCCC1c1ccc(C2CC2)cc1
InChIInChI=1S/C16H23N/c1-12(2)17-11-3-4-16(17)15-9-7-14(8-10-15)13-5-6-13/h7-10,12-13,16H,3-6,11H2,1-2H3
InChIKeyUAGVXZRSNOOTTG-UHFFFAOYSA-N
MW229.37 g/mol
LogP4.11
Rot. Bonds3

About 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine

2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine (PubChem CID 167249235) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine
PubChem CID167249235
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Name2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine
SMILESCC(C)N1CCCC1c1ccc(C2CC2)cc1
InChIInChI=1S/C16H23N/c1-12(2)17-11-3-4-16(17)15-9-7-14(8-10-15)13-5-6-13/h7-10,12-13,16H,3-6,11H2,1-2H3
InChIKeyUAGVXZRSNOOTTG-UHFFFAOYSA-N
XLogP4.11
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.37
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-(4-fluorophenyl)-1-propan-2-ylpiperidine
CID 124501109
(2S)-2-phenyl-1-propan-2-ylpiperidine
CID 140931618
(2R)-1-propan-2-yl-2-thiophen-3-ylpyrrolidine
CID 124500963
2-(4-hexylphenyl)-1-propan-2-ylpyrrolidine
CID 167237433
2-chloro-5-(1-propan-2-ylpyrrolidin-2-yl)pyridine
CID 102539185
2-(5-chlorothiophen-2-yl)-1-propan-2-ylpyrrolidine
CID 71120044
N-cyclopentyl-5-(1-propan-2-ylpyrrolidin-2-yl)pyridin-2-amine
CID 102540450
5-[(2R)-1-propan-2-ylpiperidin-2-yl]-1H-indole
CID 124501023
2-(5-methylfuran-2-yl)-1-propan-2-ylpyrrolidine
CID 157179926
1-propan-2-yl-2-(2-propan-2-ylphenyl)pyrrolidine
CID 167249257
2-[(2R)-1-propan-2-ylpyrrolidin-2-yl]pyrimidine
CID 89274443
3-[(2R)-1-propan-2-ylpyrrolidin-2-yl]quinoline
CID 124500180

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine?
The IUPAC name of 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine (CID 167249235) is 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine.
What is the SMILES notation for 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine?
The canonical SMILES for 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine is CC(C)N1CCCC1c1ccc(C2CC2)cc1.
What is the InChIKey of 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine?
The InChIKey is UAGVXZRSNOOTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N/c1-12(2)17-11-3-4-16(17)15-9-7-14(8-10-15)13-5-6-13/h7-10,12-13,16H,3-6,11H2,1-2H3.
What are the key properties of 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine?
2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine has a molecular weight of 229.37 g/mol, XLogP of 4.11, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylphenyl)-1-propan-2-ylpyrrolidine is sourced from PubChem (CID 167249235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).