3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol

C14H22N2O2 — CID 63984159

IUPAC3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol
SMILESCOc1cccc(CN2CCCC2CCCO)n1
InChIInChI=1S/C14H22N2O2/c1-18-14-8-2-5-12(15-14)11-16-9-3-6-13(16)7-4-10-17/h2,5,8,13,17H,3-4,6-7,9-11H2,1H3
InChIKeyZSMOFDWRFMZRKZ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.83
Rot. Bonds6

About 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol

3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol (PubChem CID 63984159) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol
PubChem CID63984159
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol
SMILESCOc1cccc(CN2CCCC2CCCO)n1
InChIInChI=1S/C14H22N2O2/c1-18-14-8-2-5-12(15-14)11-16-9-3-6-13(16)7-4-10-17/h2,5,8,13,17H,3-4,6-7,9-11H2,1H3
InChIKeyZSMOFDWRFMZRKZ-UHFFFAOYSA-N
XLogP1.83
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(3-bromopropyl)pyrrolidin-1-yl]methyl]-6-methoxypyridine
CID 80690069
3-[1-[2-(4-methoxyphenoxy)ethyl]pyrrolidin-2-yl]propan-1-ol
CID 62467287
3-[1-(1,3-benzoxazol-2-ylmethyl)pyrrolidin-2-yl]propan-1-ol
CID 62467617
3-[1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]pyrrolidin-2-yl]propan-1-ol
CID 110918967
3-[1-[[2-(methylsulfonylmethyl)-1,3-thiazol-4-yl]methyl]pyrrolidin-2-yl]propan-1-ol
CID 111487689
2-methoxy-6-[2-(1-methylpiperidin-2-yl)ethyl]pyridine
CID 101453040
3-[1-[(5-bromo-2-methoxyphenyl)methyl]pyrrolidin-2-yl]propan-1-ol
CID 62468345
[1-[(6-chloro-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 79037926
2-methoxy-6-(piperidin-1-ylmethyl)pyridine
CID 70652671
2-[(3-chloropiperidin-1-yl)methyl]-6-methoxypyridine
CID 63984943
3-[1-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol
CID 62467092
3-[1-(6-methoxy-2-pyridinyl)pyrrolidin-2-yl]propan-1-amine
CID 55241037

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol?
The IUPAC name of 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol (CID 63984159) is 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol?
The canonical SMILES for 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol is COc1cccc(CN2CCCC2CCCO)n1.
What is the InChIKey of 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol?
The InChIKey is ZSMOFDWRFMZRKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-18-14-8-2-5-12(15-14)11-16-9-3-6-13(16)7-4-10-17/h2,5,8,13,17H,3-4,6-7,9-11H2,1H3.
What are the key properties of 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol?
3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol has a molecular weight of 250.34 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-2-yl]propan-1-ol is sourced from PubChem (CID 63984159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).