[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol

C11H18N2O — CID 66636497

IUPAC[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol
SMILESOCc1cc(CCN2CCCC2)c[nH]1
InChIInChI=1S/C11H18N2O/c14-9-11-7-10(8-12-11)3-6-13-4-1-2-5-13/h7-8,12,14H,1-6,9H2
InChIKeyQVFCMQJEOKLSRU-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.15
Rot. Bonds4

About [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol

[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol (PubChem CID 66636497) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol
PubChem CID66636497
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol
SMILESOCc1cc(CCN2CCCC2)c[nH]1
InChIInChI=1S/C11H18N2O/c14-9-11-7-10(8-12-11)3-6-13-4-1-2-5-13/h7-8,12,14H,1-6,9H2
InChIKeyQVFCMQJEOKLSRU-UHFFFAOYSA-N
XLogP1.15
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-pyrrolidin-1-ylethyl)-1H-pyrrole-2-carbaldehyde
CID 86650825
3-(2-pyrrolidin-1-ylethyl)-1H-pyrrole
CID 174722909
bis[4-(2-pyrrolidin-1-ylethyl)phenyl]methanone
CID 57106697
1-[2-(4-chlorophenyl)ethyl]pyrrolidine
CID 22364204
5-phenylmethoxy-2-(2-pyrrolidin-1-ylethyl)-1H-pyridin-4-one
CID 15077302
1-[2-(4-hydroxysulfanylphenyl)ethyl]piperidine
CID 57495495
5-(2-piperidin-1-ylethyl)pyrimidine
CID 89299412
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]piperidin-4-ol
CID 71034592
6-(2-piperidin-1-ylethyl)naphthalene-2,3-diol;hydrochloride
CID 20541877
1-[2-(3,4-dichlorophenyl)ethyl]-4-(2-pyrrolidin-1-ylethyl)piperazine
CID 558444
1-[2-(3-prop-1-en-2-ylphenyl)ethyl]pyrrolidine
CID 22250733
1-[[4-(2-piperidin-1-ylethyl)phenyl]methyl]cyclopropan-1-ol
CID 117403000

Frequently Asked Questions

What is the IUPAC name of [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol?
The IUPAC name of [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol (CID 66636497) is [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol.
What is the SMILES notation for [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol?
The canonical SMILES for [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol is OCc1cc(CCN2CCCC2)c[nH]1.
What is the InChIKey of [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol?
The InChIKey is QVFCMQJEOKLSRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c14-9-11-7-10(8-12-11)3-6-13-4-1-2-5-13/h7-8,12,14H,1-6,9H2.
What are the key properties of [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol?
[4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol has a molecular weight of 194.28 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-pyrrolidin-1-ylethyl)-1H-pyrrol-2-yl]methanol is sourced from PubChem (CID 66636497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).