2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile

C10H13N3O — CID 64538428

IUPAC2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile
SMILESCC(C)(N)COc1ncccc1C#N
InChIInChI=1S/C10H13N3O/c1-10(2,12)7-14-9-8(6-11)4-3-5-13-9/h3-5H,7,12H2,1-2H3
InChIKeyULKTYJHJDPKSOE-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.07
Rot. Bonds3

About 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile

2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile (PubChem CID 64538428) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile
PubChem CID64538428
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile
SMILESCC(C)(N)COc1ncccc1C#N
InChIInChI=1S/C10H13N3O/c1-10(2,12)7-14-9-8(6-11)4-3-5-13-9/h3-5H,7,12H2,1-2H3
InChIKeyULKTYJHJDPKSOE-UHFFFAOYSA-N
XLogP1.07
TPSA71.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,3-dimethylbutoxy)pyridine-3-carbonitrile
CID 66231573
2-(2,2,3,3,4,4,5,5,5-nonafluoropentoxy)pyridine-3-carbonitrile
CID 167152493
2-hexoxypyridine-3-carbonitrile
CID 29001326
2-[(2-amino-2-methylpropyl)amino]pyridine-3-carbonitrile
CID 78954580
2-phenylmethoxypyridine-3-carbonitrile
CID 12604511
2-(4,4,4-trifluorobutoxy)pyridine-3-carbonitrile
CID 54400483
ethyl 2-[(3-cyano-2-pyridinyl)oxy]acetate
CID 134128969
2-(2-butoxyethoxy)pyridine-3-carbonitrile
CID 29001144
2-[[1-(aminomethyl)cyclopropyl]methoxy]pyridine-3-carbonitrile
CID 117096438
2-methyl-1-pyrimidin-2-yloxypropan-2-amine
CID 64536005
2-(2-pyridin-3-ylpropan-2-yloxy)pyridine-3-carbonitrile
CID 117096489
2-(2,3-dihydroxypropoxy)pyridine-3-carbonitrile
CID 12529033

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile?
The IUPAC name of 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile (CID 64538428) is 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile.
What is the SMILES notation for 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile?
The canonical SMILES for 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile is CC(C)(N)COc1ncccc1C#N.
What is the InChIKey of 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile?
The InChIKey is ULKTYJHJDPKSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-10(2,12)7-14-9-8(6-11)4-3-5-13-9/h3-5H,7,12H2,1-2H3.
What are the key properties of 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile?
2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile has a molecular weight of 191.23 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropoxy)pyridine-3-carbonitrile is sourced from PubChem (CID 64538428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).