(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol

C10H17N3O — CID 80648091

IUPAC(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol
SMILESCC(C)[C@@H](CO)Nc1cccc(N)n1
InChIInChI=1S/C10H17N3O/c1-7(2)8(6-14)12-10-5-3-4-9(11)13-10/h3-5,7-8,14H,6H2,1-2H3,(H3,11,12,13)/t8-/m1/s1
InChIKeyFZYKLIHFSPXORS-MRVPVSSYSA-N
MW195.27 g/mol
LogP1.09
Rot. Bonds4

About (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol

(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol (PubChem CID 80648091) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol.

Molecular Properties

Compound Name(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol
PubChem CID80648091
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol
SMILESCC(C)[C@@H](CO)Nc1cccc(N)n1
InChIInChI=1S/C10H17N3O/c1-7(2)8(6-14)12-10-5-3-4-9(11)13-10/h3-5,7-8,14H,6H2,1-2H3,(H3,11,12,13)/t8-/m1/s1
InChIKeyFZYKLIHFSPXORS-MRVPVSSYSA-N
XLogP1.09
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol with MolForge

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Related Compounds

2-[[6-(aminomethyl)-2-pyridinyl]amino]-3-methylbutan-1-ol
CID 79254007
(2S)-3-methyl-2-[[6-(methylamino)-2-pyridinyl]amino]butan-1-ol
CID 80848987
2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-3-methylbutan-1-ol
CID 79248203
2-[(5-aminopyrazin-2-yl)amino]-3-methylbutan-1-ol
CID 80653720
2-[(6-amino-2-pyridinyl)amino]-2-phenylethanol
CID 80647264
2-[(6-amino-2-pyridinyl)amino]propanamide
CID 80647728
3-amino-6-[(1-hydroxy-3-methylbutan-2-yl)amino]pyridine-2-carbonitrile
CID 103468731
(2S)-2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-3-methylbutan-1-ol
CID 79248758
6-N-(4-methylhexan-2-yl)pyridine-2,6-diamine
CID 80647171
(2S)-2-[[2-amino-6-(methylamino)pyrimidin-4-yl]amino]-3-methylbutan-1-ol
CID 80848437
2-[(4-amino-2-pyridinyl)amino]-3-methylbutan-1-ol
CID 79248276
3-methyl-2-N-(6-methyl-2-pyridinyl)butane-1,2-diamine
CID 65192341

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol?
The IUPAC name of (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol (CID 80648091) is (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol.
What is the SMILES notation for (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol?
The canonical SMILES for (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol is CC(C)[C@@H](CO)Nc1cccc(N)n1.
What is the InChIKey of (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol?
The InChIKey is FZYKLIHFSPXORS-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-7(2)8(6-14)12-10-5-3-4-9(11)13-10/h3-5,7-8,14H,6H2,1-2H3,(H3,11,12,13)/t8-/m1/s1.
What are the key properties of (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol?
(2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol has a molecular weight of 195.27 g/mol, XLogP of 1.09, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(6-amino-2-pyridinyl)amino]-3-methylbutan-1-ol is sourced from PubChem (CID 80648091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).