[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol

C13H20N2O2 — CID 80632448

IUPAC[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1N(C)CC1CCCO1
InChIInChI=1S/C13H20N2O2/c1-10-6-11(9-16)7-14-13(10)15(2)8-12-4-3-5-17-12/h6-7,12,16H,3-5,8-9H2,1-2H3
InChIKeyXRVBVXCJYVDQOC-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.50
Rot. Bonds4

About [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol

[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol (PubChem CID 80632448) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol
PubChem CID80632448
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1N(C)CC1CCCO1
InChIInChI=1S/C13H20N2O2/c1-10-6-11(9-16)7-14-13(10)15(2)8-12-4-3-5-17-12/h6-7,12,16H,3-5,8-9H2,1-2H3
InChIKeyXRVBVXCJYVDQOC-UHFFFAOYSA-N
XLogP1.50
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(bromomethyl)-N,3-dimethyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 107081226
5-[(tert-butylamino)methyl]-N,3-dimethyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 80631769
N,3-dimethyl-N-(oxan-2-ylmethyl)-5-(propylaminomethyl)pyridin-2-amine
CID 80631876
[5-[methyl(oxolan-2-ylmethyl)amino]pyrazin-2-yl]methanol
CID 107372756
2-N,4-N,5-trimethyl-2-N,4-N-bis[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4-diamine
CID 124859594
3-chloro-N-methyl-5-(methylaminomethyl)-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 62281998
5-bromo-N-methyl-3-(methylaminomethyl)-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 62295126
1-[[5-(hydroxymethyl)-3-methyl-2-pyridinyl]-methylamino]propan-2-ol
CID 80629194
[6-[cyclopentyl(ethyl)amino]-5-methyl-3-pyridinyl]methanol
CID 80631422
[5-methyl-2-[methyl(oxolan-2-ylmethyl)amino]phenyl]methanol
CID 114054435
[2-[methyl(oxan-2-ylmethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62753863
5-amino-2-[methyl(oxan-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 61431773

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol (CID 80632448) is [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol is Cc1cc(CO)cnc1N(C)CC1CCCO1.
What is the InChIKey of [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol?
The InChIKey is XRVBVXCJYVDQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10-6-11(9-16)7-14-13(10)15(2)8-12-4-3-5-17-12/h6-7,12,16H,3-5,8-9H2,1-2H3.
What are the key properties of [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol?
[5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol has a molecular weight of 236.31 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-[methyl(oxolan-2-ylmethyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 80632448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).