2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol

C12H20N2O — CID 61049210

IUPAC2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol
SMILESCCC(C)NC(C)(CO)c1ccccn1
InChIInChI=1S/C12H20N2O/c1-4-10(2)14-12(3,9-15)11-7-5-6-8-13-11/h5-8,10,14-15H,4,9H2,1-3H3
InChIKeyROWKKKRKYBTADW-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.68
Rot. Bonds5

About 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol

2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol (PubChem CID 61049210) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol
PubChem CID61049210
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol
SMILESCCC(C)NC(C)(CO)c1ccccn1
InChIInChI=1S/C12H20N2O/c1-4-10(2)14-12(3,9-15)11-7-5-6-8-13-11/h5-8,10,14-15H,4,9H2,1-3H3
InChIKeyROWKKKRKYBTADW-UHFFFAOYSA-N
XLogP1.68
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-fluoroanilino)-2-pyridin-2-ylpropan-1-ol
CID 61050104
2-(butan-2-ylamino)-2-(4-chlorophenyl)propan-1-ol
CID 61049008
2-(5-bromofuran-2-yl)-2-(butan-2-ylamino)propan-1-ol
CID 104653909
2-(2-pyridin-2-ylpropan-2-yloxy)ethanol
CID 141291865
2-(methylamino)-2,2-dipyridin-2-ylethanol
CID 171393738
2-(3-fluoro-5-methylanilino)-2-pyridin-2-ylpropan-1-ol
CID 79047415
2-(butan-2-ylamino)-2-(4-methylsulfanylphenyl)propan-1-ol
CID 61048813
2-(butan-2-ylamino)-2-[4-(dimethylamino)phenyl]propan-1-ol
CID 61049003
2-pyridin-2-ylbutane-2,3-diamine
CID 87362021
(2S)-3-methyl-2-pyridin-2-ylbutan-2-ol
CID 162467836
3-methyl-3-pyridin-2-ylpentan-1-ol
CID 144773779
1-pyridin-2-ylpropane-1,1-diol
CID 18373059

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol?
The IUPAC name of 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol (CID 61049210) is 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol is CCC(C)NC(C)(CO)c1ccccn1.
What is the InChIKey of 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol?
The InChIKey is ROWKKKRKYBTADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-10(2)14-12(3,9-15)11-7-5-6-8-13-11/h5-8,10,14-15H,4,9H2,1-3H3.
What are the key properties of 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol?
2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol has a molecular weight of 208.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-2-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 61049210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).