6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine

C12H19N3O — CID 178156266

IUPAC6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine
SMILESCN(C)Cc1nc(N)ccc1[C@@H]1CCOC1
InChIInChI=1S/C12H19N3O/c1-15(2)7-11-10(3-4-12(13)14-11)9-5-6-16-8-9/h3-4,9H,5-8H2,1-2H3,(H2,13,14)/t9-/m1/s1
InChIKeyOQNOBVFOKCJBRO-SECBINFHSA-N
MW221.30 g/mol
LogP1.23
Rot. Bonds3

About 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine

6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine (PubChem CID 178156266) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine.

Molecular Properties

Compound Name6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine
PubChem CID178156266
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine
SMILESCN(C)Cc1nc(N)ccc1[C@@H]1CCOC1
InChIInChI=1S/C12H19N3O/c1-15(2)7-11-10(3-4-12(13)14-11)9-5-6-16-8-9/h3-4,9H,5-8H2,1-2H3,(H2,13,14)/t9-/m1/s1
InChIKeyOQNOBVFOKCJBRO-SECBINFHSA-N
XLogP1.23
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-[[6-amino-3-(oxolan-3-yl)-2-pyridinyl]methyl]-N-methylcarbamate;tert-butyl N-[[6-(cyclopropanecarbonylamino)-3-(oxolan-3-yl)-2-pyridinyl]methyl]-N-methylcarbamate
CID 161042218
[6-[(dimethylamino)methyl]-5-[(3R)-oxolan-3-yl]-2-pyridinyl] N-tert-butylcarbamate
CID 175330279
N,N-dimethyl-1-[5-methyl-2-[(3R)-oxolan-3-yl]phenyl]methanamine
CID 165400243
N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine
CID 164926766
ethane;2,2,2-trifluoro-N-methyl-N-[[6-methyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 172576226
N-[[6-ethyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]-2,2,2-trifluoro-N-methylethanamine
CID 156651300
N,N-dimethyl-1-[3-(oxan-4-yl)-2-pyridinyl]methanamine;ethane
CID 156651522
6-[1-(dimethylamino)ethyl]-5-(oxan-4-yl)pyridin-2-amine
CID 167458628
N-[[6-butan-2-yl-3-[(3S)-oxolan-3-yl]-2-pyridinyl]methyl]-2-methoxy-N-methylethanamine
CID 156652222
[6-butan-2-yl-3-(oxolan-3-yl)-2-pyridinyl]methanamine
CID 165400069
N,N-dimethyl-2-[8-[(3R)-oxolan-3-yl]naphthalen-1-yl]ethanamine
CID 178091325
N-[6-[(dimethylamino)methyl]-5-[(3R)-oxolan-3-yl]-2-pyridinyl]-4-(1-methylindol-4-yl)-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-7-amine
CID 166682746

Frequently Asked Questions

What is the IUPAC name of 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine?
The IUPAC name of 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine (CID 178156266) is 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine.
What is the SMILES notation for 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine?
The canonical SMILES for 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine is CN(C)Cc1nc(N)ccc1[C@@H]1CCOC1.
What is the InChIKey of 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine?
The InChIKey is OQNOBVFOKCJBRO-SECBINFHSA-N. The full InChI is InChI=1S/C12H19N3O/c1-15(2)7-11-10(3-4-12(13)14-11)9-5-6-16-8-9/h3-4,9H,5-8H2,1-2H3,(H2,13,14)/t9-/m1/s1.
What are the key properties of 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine?
6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine has a molecular weight of 221.30 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine is sourced from PubChem (CID 178156266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).