1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol

C17H26N2O2 — CID 143833939

IUPAC1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol
SMILESCOc1ccc(C2CNC[C@@H]2CN2CCC(O)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-21-16-4-2-13(3-5-16)17-11-18-10-14(17)12-19-8-6-15(20)7-9-19/h2-5,14-15,17-18,20H,6-12H2,1H3/t14-,17?/m1/s1
InChIKeyHBBQIKYUTAZBEY-XPCCGILXSA-N
MW290.41 g/mol
LogP1.45
Rot. Bonds4

About 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol

1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol (PubChem CID 143833939) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol
PubChem CID143833939
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol
SMILESCOc1ccc(C2CNC[C@@H]2CN2CCC(O)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-21-16-4-2-13(3-5-16)17-11-18-10-14(17)12-19-8-6-15(20)7-9-19/h2-5,14-15,17-18,20H,6-12H2,1H3/t14-,17?/m1/s1
InChIKeyHBBQIKYUTAZBEY-XPCCGILXSA-N
XLogP1.45
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S,4S)-3-ethyl-4-(4-methoxyphenyl)pyrrolidine
CID 124705549
1-[[(3S,4R)-4-hydroxy-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol
CID 141364615
(4S)-3-(4-methoxyphenyl)-4-methylpyrrolidine
CID 58606780
2-[(4-methoxyphenyl)methyl]-8-[(4-phenylpyrrolidin-3-yl)methyl]-2,8-diazaspiro[4.5]decan-1-one
CID 67368996
1-[[4-(4-fluorophenyl)pyrrolidin-3-yl]methyl]piperidine
CID 42863556
2-[(4-methoxyphenyl)methyl]-8-[[(3R,4S)-4-phenylpyrrolidin-3-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 58982011
(4-methoxyphenyl)-[3-(4-methoxyphenyl)-4-[(4-methylpiperidin-1-yl)methyl]pyrrolidin-1-yl]methanone
CID 42862684
1-[3-(4-methoxyphenyl)-4-[(4-methylpiperidin-1-yl)methyl]pyrrolidin-1-yl]-2-methylpropan-1-one
CID 42862683
(3R,4R)-4-(4-methoxyphenyl)pyrrolidine-3-carboxylic acid
CID 7145970
4-(4-methoxyphenyl)-1-prop-2-ynylpiperidin-3-ol
CID 3231134
N-(cyclopropylmethyl)-4-(4-methoxyphenyl)pyrrolidine-3-carboxamide
CID 42825230
(3R,4R)-1-benzyl-4-(4-methoxyphenyl)piperidin-3-ol
CID 118207526

Frequently Asked Questions

What is the IUPAC name of 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol?
The IUPAC name of 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol (CID 143833939) is 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol.
What is the SMILES notation for 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol?
The canonical SMILES for 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol is COc1ccc(C2CNC[C@@H]2CN2CCC(O)CC2)cc1.
What is the InChIKey of 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol?
The InChIKey is HBBQIKYUTAZBEY-XPCCGILXSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-21-16-4-2-13(3-5-16)17-11-18-10-14(17)12-19-8-6-15(20)7-9-19/h2-5,14-15,17-18,20H,6-12H2,1H3/t14-,17?/m1/s1.
What are the key properties of 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol?
1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol has a molecular weight of 290.41 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(3R)-4-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]piperidin-4-ol is sourced from PubChem (CID 143833939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).