1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol

C11H16N2O2 — CID 103456736

IUPAC1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol
SMILESCc1ccnc(N)c1C(O)C(O)C1CC1
InChIInChI=1S/C11H16N2O2/c1-6-4-5-13-11(12)8(6)10(15)9(14)7-2-3-7/h4-5,7,9-10,14-15H,2-3H2,1H3,(H2,12,13)
InChIKeyHUTMXTJRIAHDEK-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.78
Rot. Bonds3

About 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol

1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol (PubChem CID 103456736) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol.

Molecular Properties

Compound Name1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol
PubChem CID103456736
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol
SMILESCc1ccnc(N)c1C(O)C(O)C1CC1
InChIInChI=1S/C11H16N2O2/c1-6-4-5-13-11(12)8(6)10(15)9(14)7-2-3-7/h4-5,7,9-10,14-15H,2-3H2,1H3,(H2,12,13)
InChIKeyHUTMXTJRIAHDEK-UHFFFAOYSA-N
XLogP0.78
TPSA79.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-amino-4-methyl-3-pyridinyl)-2-cyclohexylethane-1,2-diol
CID 103458996
(2-amino-4-methyl-3-pyridinyl)-(3,3-difluorocyclohexyl)methanol
CID 114215752
3-[(4-ethylcyclohexyl)-(methylamino)methyl]-4-methylpyridin-2-amine
CID 65392904
3-[(4-ethylcyclohexyl)-hydrazinylmethyl]-4-methylpyridin-2-amine
CID 105231546
cyclopropyl-(2-fluoro-4-methyl-3-pyridinyl)methanol
CID 176820199
(2-amino-4-methyl-3-pyridinyl)-(2-methylfuran-3-yl)methanol
CID 104789433
(2-amino-4-methyl-3-pyridinyl)-(2-aminophenyl)methanol
CID 64832179
4-methyl-3-[methylamino(oxolan-3-yl)methyl]pyridin-2-amine
CID 65329909
3-amino-1-(2-amino-4-methyl-3-pyridinyl)-3-cyclopropylpropan-1-one
CID 116608700
4-[(2-amino-4-methyl-3-pyridinyl)-hydroxymethyl]benzonitrile
CID 115480865
(2-amino-4-methyl-3-pyridinyl)-[3-(difluoromethyl)phenyl]methanol
CID 115527804
3-(1-amino-2-ethylsulfanylethyl)-4-methylpyridin-2-amine
CID 65128071

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol?
The IUPAC name of 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol (CID 103456736) is 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol.
What is the SMILES notation for 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol?
The canonical SMILES for 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol is Cc1ccnc(N)c1C(O)C(O)C1CC1.
What is the InChIKey of 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol?
The InChIKey is HUTMXTJRIAHDEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-6-4-5-13-11(12)8(6)10(15)9(14)7-2-3-7/h4-5,7,9-10,14-15H,2-3H2,1H3,(H2,12,13).
What are the key properties of 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol?
1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol has a molecular weight of 208.26 g/mol, XLogP of 0.78, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-4-methyl-3-pyridinyl)-2-cyclopropylethane-1,2-diol is sourced from PubChem (CID 103456736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).