2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol

C16H29NO2 — CID 103144085

IUPAC2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
SMILESCC1CCC(CN2CCCC2C2CCCCC2O)O1
InChIInChI=1S/C16H29NO2/c1-12-8-9-13(19-12)11-17-10-4-6-15(17)14-5-2-3-7-16(14)18/h12-16,18H,2-11H2,1H3
InChIKeyVDVJWZOSWSLQMR-UHFFFAOYSA-N
MW267.41 g/mol
LogP2.57
Rot. Bonds3

About 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol

2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol (PubChem CID 103144085) has the molecular formula C16H29NO2 and a molecular weight of 267.41 g/mol. Its IUPAC name is 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
PubChem CID103144085
Molecular FormulaC16H29NO2
Molecular Weight267.41 g/mol
Exact Mass267.22
IUPAC Name2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol
SMILESCC1CCC(CN2CCCC2C2CCCCC2O)O1
InChIInChI=1S/C16H29NO2/c1-12-8-9-13(19-12)11-17-10-4-6-15(17)14-5-2-3-7-16(14)18/h12-16,18H,2-11H2,1H3
InChIKeyVDVJWZOSWSLQMR-UHFFFAOYSA-N
XLogP2.57
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.41
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[2-(2,2,2-Trifluoroethoxy)ethyl]pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339663
(2R)-1-[(2S)-4-methoxy-1-methylpyrrolidin-2-yl]-2-methylbutan-1-ol
CID 59953233
2-[3-[2-(3-Methyloxiran-2-yl)pyrrolidin-1-yl]oxiran-2-yl]cyclohexan-1-ol
CID 132047500
[1-[2-[4-(Cyclohexylmethyl)cyclohexyl]oxyethyl]pyrrolidin-2-yl]methanol
CID 140449940
[1-[2-(4-Ethyloxan-2-yl)ethyl]pyrrolidin-2-yl]methanol
CID 156242734
1-(4-Methoxy-1-methylpyrrolidin-2-yl)-2-methylbutan-1-ol
CID 20647905
2-[[Methyl(oxolan-2-ylmethyl)amino]methyl]-4-propylcyclohexan-1-ol
CID 55094486
2-[[Ethyl(oxolan-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 55094912
5-Cyclohexyl-1-(2-ethoxyethyl)pyrrolidin-3-ol
CID 56790756
2-[Ethyl(oxolan-2-ylmethyl)amino]-4-propylcyclohexan-1-ol
CID 61764398
4-Ethyl-2-[ethyl(oxolan-2-ylmethyl)amino]cyclohexan-1-ol
CID 61764787
2-[Methyl(oxolan-2-ylmethyl)amino]-4-propylcyclohexan-1-ol
CID 61766757

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol (CID 103144085) is 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol is CC1CCC(CN2CCCC2C2CCCCC2O)O1.
What is the InChIKey of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
The InChIKey is VDVJWZOSWSLQMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29NO2/c1-12-8-9-13(19-12)11-17-10-4-6-15(17)14-5-2-3-7-16(14)18/h12-16,18H,2-11H2,1H3.
What are the key properties of 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol?
2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol has a molecular weight of 267.41 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(5-methyloxolan-2-yl)methyl]pyrrolidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 103144085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).