(4-methylphenyl)-piperidin-3-ylmethanol

C13H19NO — CID 43146496

IUPAC(4-methylphenyl)-piperidin-3-ylmethanol
SMILESCc1ccc(C(O)C2CCCNC2)cc1
InChIInChI=1S/C13H19NO/c1-10-4-6-11(7-5-10)13(15)12-3-2-8-14-9-12/h4-7,12-15H,2-3,8-9H2,1H3
InChIKeyTVDQUEAXDYHWIO-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.03
Rot. Bonds2

About (4-methylphenyl)-piperidin-3-ylmethanol

(4-methylphenyl)-piperidin-3-ylmethanol (PubChem CID 43146496) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (4-methylphenyl)-piperidin-3-ylmethanol.

Molecular Properties

Compound Name(4-methylphenyl)-piperidin-3-ylmethanol
PubChem CID43146496
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(4-methylphenyl)-piperidin-3-ylmethanol
SMILESCc1ccc(C(O)C2CCCNC2)cc1
InChIInChI=1S/C13H19NO/c1-10-4-6-11(7-5-10)13(15)12-3-2-8-14-9-12/h4-7,12-15H,2-3,8-9H2,1H3
InChIKeyTVDQUEAXDYHWIO-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-phenyl-[(3S)-piperidin-3-yl]methanol
CID 39238461
(4-fluoro-3-methylphenyl)-piperidin-3-ylmethanol
CID 79023931
[4-[(2-methylpropan-2-yl)oxy]phenyl]-piperidin-3-ylmethanol
CID 82303366
[4-(2-methylbutan-2-yl)phenyl]-piperidin-3-ylmethanol
CID 66259760
3-[1-(4-methylphenyl)propyl]piperidine
CID 83910141
(S)-(4-methylphenyl)-[(2R)-pyrrolidin-2-yl]methanol
CID 39238470
4-(1-piperidin-3-ylethyl)phenol
CID 83908771
ethane;(4-methylphenyl)-pyrrolidin-2-ylmethanol
CID 142507494
cyclopropyl-[4-(4-methylphenyl)phenyl]methanol
CID 175668827
(3-chlorophenyl)-[(3R)-piperidin-3-yl]methanol
CID 67190676
[4-(1-methylpyrazolo[3,4-b]pyridin-5-yl)phenyl]-piperidin-3-ylmethanol
CID 167893520
piperidin-3-yl-[4-[4-(1,2,4-triazol-1-ylmethyl)phenyl]phenyl]methanol
CID 167761587

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-piperidin-3-ylmethanol?
The IUPAC name of (4-methylphenyl)-piperidin-3-ylmethanol (CID 43146496) is (4-methylphenyl)-piperidin-3-ylmethanol.
What is the SMILES notation for (4-methylphenyl)-piperidin-3-ylmethanol?
The canonical SMILES for (4-methylphenyl)-piperidin-3-ylmethanol is Cc1ccc(C(O)C2CCCNC2)cc1.
What is the InChIKey of (4-methylphenyl)-piperidin-3-ylmethanol?
The InChIKey is TVDQUEAXDYHWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-4-6-11(7-5-10)13(15)12-3-2-8-14-9-12/h4-7,12-15H,2-3,8-9H2,1H3.
What are the key properties of (4-methylphenyl)-piperidin-3-ylmethanol?
(4-methylphenyl)-piperidin-3-ylmethanol has a molecular weight of 205.30 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-piperidin-3-ylmethanol is sourced from PubChem (CID 43146496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).