1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol

C9H15N3O — CID 80780222

IUPAC1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol
SMILESCNc1cccc(NCC(C)O)n1
InChIInChI=1S/C9H15N3O/c1-7(13)6-11-9-5-3-4-8(10-2)12-9/h3-5,7,13H,6H2,1-2H3,(H2,10,11,12)
InChIKeyNWAUCMRFCMUYSB-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.92
Rot. Bonds4

About 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol

1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol (PubChem CID 80780222) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol
PubChem CID80780222
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol
SMILESCNc1cccc(NCC(C)O)n1
InChIInChI=1S/C9H15N3O/c1-7(13)6-11-9-5-3-4-8(10-2)12-9/h3-5,7,13H,6H2,1-2H3,(H2,10,11,12)
InChIKeyNWAUCMRFCMUYSB-UHFFFAOYSA-N
XLogP0.92
TPSA57.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-methyl-6-N-(2-methyl-3-methylsulfanylpropyl)pyridine-2,6-diamine
CID 80839793
1-[[2-tert-butyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80967240
1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80933620
1-[2-[(6-methyl-2-pyridinyl)amino]ethylamino]propan-2-ol
CID 104594292
(1S)-2-(tert-butylamino)-1-[6-(methylamino)-2-pyridinyl]ethanol
CID 155154418
1-[(6-hydrazinyl-2-pyridinyl)amino]-4-methylpentan-2-ol
CID 107159891
1-[[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80967408
2-methyl-1-[[6-(methylamino)-2-pyridinyl]amino]butan-2-ol
CID 80842101
(2R)-1-[(2-chloropyrimidin-4-yl)amino]propan-2-ol
CID 94405682
(2S)-3-methyl-2-[[6-(methylamino)-2-pyridinyl]amino]butan-1-ol
CID 80848987
6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
CID 80778351
N-[2-[[6-(methylamino)-2-pyridinyl]amino]ethyl]acetamide
CID 80786842

Frequently Asked Questions

What is the IUPAC name of 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol?
The IUPAC name of 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol (CID 80780222) is 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol.
What is the SMILES notation for 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol?
The canonical SMILES for 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol is CNc1cccc(NCC(C)O)n1.
What is the InChIKey of 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol?
The InChIKey is NWAUCMRFCMUYSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7(13)6-11-9-5-3-4-8(10-2)12-9/h3-5,7,13H,6H2,1-2H3,(H2,10,11,12).
What are the key properties of 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol?
1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol has a molecular weight of 181.24 g/mol, XLogP of 0.92, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol is sourced from PubChem (CID 80780222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).