1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol

C16H24N2O — CID 63294792

IUPAC1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol
SMILESOC(CNCc1ccccc1N1CCCC1)C1CC1
InChIInChI=1S/C16H24N2O/c19-16(13-7-8-13)12-17-11-14-5-1-2-6-15(14)18-9-3-4-10-18/h1-2,5-6,13,16-17,19H,3-4,7-12H2
InChIKeyDWOCANZJGJKHIT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.15
Rot. Bonds6

About 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol

1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol (PubChem CID 63294792) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol
PubChem CID63294792
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol
SMILESOC(CNCc1ccccc1N1CCCC1)C1CC1
InChIInChI=1S/C16H24N2O/c19-16(13-7-8-13)12-17-11-14-5-1-2-6-15(14)18-9-3-4-10-18/h1-2,5-6,13,16-17,19H,3-4,7-12H2
InChIKeyDWOCANZJGJKHIT-UHFFFAOYSA-N
XLogP2.15
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyrrolidin-1-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]propan-1-amine
CID 112727664
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CID 110013047
2-methyl-N-[[2-(4-propan-2-ylpiperidin-1-yl)phenyl]methyl]propan-1-amine
CID 103499393
1-[(2-morpholin-4-ylphenyl)methylamino]-3-pyrrolidin-1-ylpropan-2-ol
CID 110928639
1-[1-[2-(propylaminomethyl)phenyl]piperidin-4-yl]ethanol
CID 106836661
N-[(2-bromophenyl)methyl]-1-(2-pyrrolidin-1-ylphenyl)methanamine
CID 61402192
1-[[(2-pyrrolidin-1-ylphenyl)methylamino]methyl]cyclobutan-1-ol
CID 115621560
1-cyclohexyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 62405544
N-[(2-piperidin-1-ylphenyl)methyl]propan-2-amine
CID 43213770
N-[[2-(azepan-1-yl)phenyl]methyl]propan-2-amine
CID 43280522
N-[(2-pyrrolidin-1-ylphenyl)methyl]but-2-yn-1-amine
CID 113342039
N-[[2-(4,4-dimethylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 62932460

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol?
The IUPAC name of 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol (CID 63294792) is 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol.
What is the SMILES notation for 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol?
The canonical SMILES for 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol is OC(CNCc1ccccc1N1CCCC1)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol?
The InChIKey is DWOCANZJGJKHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c19-16(13-7-8-13)12-17-11-14-5-1-2-6-15(14)18-9-3-4-10-18/h1-2,5-6,13,16-17,19H,3-4,7-12H2.
What are the key properties of 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol?
1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol has a molecular weight of 260.38 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]ethanol is sourced from PubChem (CID 63294792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).