5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile

C12H15N3 — CID 115487708

IUPAC5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile
SMILESCC1CC1CN(C)c1ccc(C#N)nc1
InChIInChI=1S/C12H15N3/c1-9-5-10(9)8-15(2)12-4-3-11(6-13)14-7-12/h3-4,7,9-10H,5,8H2,1-2H3
InChIKeyDRPLEHJUYADIIO-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.05
Rot. Bonds3

About 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile

5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile (PubChem CID 115487708) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile
PubChem CID115487708
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile
SMILESCC1CC1CN(C)c1ccc(C#N)nc1
InChIInChI=1S/C12H15N3/c1-9-5-10(9)8-15(2)12-4-3-11(6-13)14-7-12/h3-4,7,9-10H,5,8H2,1-2H3
InChIKeyDRPLEHJUYADIIO-UHFFFAOYSA-N
XLogP2.05
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]pyridine-2-carbonitrile
CID 113320651
5-[2-cyanopropyl(methyl)amino]pyridine-2-carbonitrile
CID 115487373
5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile
CID 130563574
5-[methyl(3,3,3-trifluoropropyl)amino]pyridine-2-carbonitrile
CID 115487744
5-[(2-methoxyphenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 79838727
5-[azetidin-3-yl(ethyl)amino]pyridine-2-carbonitrile
CID 115490430
5-[methyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 115487439
5-[(5-amino-2-chlorophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 115490495
5-[furan-2-ylmethyl(methyl)amino]pyridine-2-carbonitrile
CID 79840143
5-[methyl-(1-methylpiperidin-4-yl)amino]pyridine-2-carbonitrile
CID 113320538
5-[bis(trimethylsilyl)amino]pyridine-2-carbonitrile
CID 66606827
4-methyl-2-[methyl-[(2-methylcyclopropyl)methyl]amino]benzonitrile
CID 63864723

Frequently Asked Questions

What is the IUPAC name of 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile?
The IUPAC name of 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile (CID 115487708) is 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile is CC1CC1CN(C)c1ccc(C#N)nc1.
What is the InChIKey of 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile?
The InChIKey is DRPLEHJUYADIIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-9-5-10(9)8-15(2)12-4-3-11(6-13)14-7-12/h3-4,7,9-10H,5,8H2,1-2H3.
What are the key properties of 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile?
5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile has a molecular weight of 201.27 g/mol, XLogP of 2.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile is sourced from PubChem (CID 115487708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).