2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol

C14H21N5O — CID 110271015

IUPAC2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol
SMILESCn1ccnc1CN1CCC(c2cc(CCO)[nH]n2)C1
InChIInChI=1S/C14H21N5O/c1-18-6-4-15-14(18)10-19-5-2-11(9-19)13-8-12(3-7-20)16-17-13/h4,6,8,11,20H,2-3,5,7,9-10H2,1H3,(H,16,17)
InChIKeyZGALHFABDPZBGC-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.67
Rot. Bonds5

About 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol

2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol (PubChem CID 110271015) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol.

Molecular Properties

Compound Name2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol
PubChem CID110271015
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol
SMILESCn1ccnc1CN1CCC(c2cc(CCO)[nH]n2)C1
InChIInChI=1S/C14H21N5O/c1-18-6-4-15-14(18)10-19-5-2-11(9-19)13-8-12(3-7-20)16-17-13/h4,6,8,11,20H,2-3,5,7,9-10H2,1H3,(H,16,17)
InChIKeyZGALHFABDPZBGC-UHFFFAOYSA-N
XLogP0.67
TPSA69.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol with MolForge

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Related Compounds

2-[3-[(3S)-1-pyrimidin-2-ylpyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol
CID 95840747
2-[3-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]-1H-pyrazol-5-yl]ethanol
CID 95824466
2-[3-(1-cyclopentylpyrrolidin-3-yl)-1H-pyrazol-5-yl]ethanol
CID 127252335
2-[3-[1-(2-methylpyrimidin-4-yl)pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol
CID 110271021
5-methyl-2-[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyridine
CID 110257106
[3-[5-(2-hydroxyethyl)-1H-pyrazol-3-yl]pyrrolidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 110270992
1-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]piperazine
CID 120968218
N-methyl-6-[1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyridin-2-amine
CID 110257105
2-methyl-4-[(3S)-1-[(1-methylimidazol-2-yl)methyl]piperidin-3-yl]pyrimidine
CID 95816201
N-methyl-1-[(1-methylimidazol-2-yl)methyl]piperidin-4-amine
CID 63295696
1-[(1-methylimidazol-2-yl)methyl]piperidine-4-carboxylic acid
CID 42961844
5-[2-(4-chlorophenoxy)ethyl]-3-[1-[(2-methylpyrazol-3-yl)methyl]pyrrolidin-3-yl]-1H-pyrazole
CID 110261448

Frequently Asked Questions

What is the IUPAC name of 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol?
The IUPAC name of 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol (CID 110271015) is 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol.
What is the SMILES notation for 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol?
The canonical SMILES for 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol is Cn1ccnc1CN1CCC(c2cc(CCO)[nH]n2)C1.
What is the InChIKey of 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol?
The InChIKey is ZGALHFABDPZBGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-18-6-4-15-14(18)10-19-5-2-11(9-19)13-8-12(3-7-20)16-17-13/h4,6,8,11,20H,2-3,5,7,9-10H2,1H3,(H,16,17).
What are the key properties of 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol?
2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol has a molecular weight of 275.36 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[1-[(1-methylimidazol-2-yl)methyl]pyrrolidin-3-yl]-1H-pyrazol-5-yl]ethanol is sourced from PubChem (CID 110271015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).