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

C10H14N4 — CID 130563574

IUPAC5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile
SMILESCC(N)CN(C)c1ccc(C#N)nc1
InChIInChI=1S/C10H14N4/c1-8(12)7-14(2)10-4-3-9(5-11)13-6-10/h3-4,6,8H,7,12H2,1-2H3
InChIKeyQLMJCIHELLPOMY-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.74
Rot. Bonds3

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

5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile (PubChem CID 130563574) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile
PubChem CID130563574
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile
SMILESCC(N)CN(C)c1ccc(C#N)nc1
InChIInChI=1S/C10H14N4/c1-8(12)7-14(2)10-4-3-9(5-11)13-6-10/h3-4,6,8H,7,12H2,1-2H3
InChIKeyQLMJCIHELLPOMY-UHFFFAOYSA-N
XLogP0.74
TPSA65.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-cyanopropyl(methyl)amino]pyridine-2-carbonitrile
CID 115487373
5-[methyl(propan-2-yl)amino]pyridine-2-carbonitrile
CID 115487439
5-[methyl(3,3,3-trifluoropropyl)amino]pyridine-2-carbonitrile
CID 115487744
5-[[(2R)-2-hydroxy-3-(4-methylpiperazin-1-yl)propyl]-methylamino]pyridine-2-carbonitrile
CID 99857839
5-[methyl-[(2-methylcyclopropyl)methyl]amino]pyridine-2-carbonitrile
CID 115487708
(2S)-1-N-methyl-1-N-(4-methylphenyl)propane-1,2-diamine
CID 28772456
5-[(5-amino-2-chlorophenyl)methyl-methylamino]pyridine-2-carbonitrile
CID 115490495
5-[furan-2-ylmethyl(methyl)amino]pyridine-2-carbonitrile
CID 79840143
5-[bis(trimethylsilyl)amino]pyridine-2-carbonitrile
CID 66606827
5-[1-(diethylamino)propan-2-ylamino]pyridine-2-carbonitrile
CID 79839031
5-(4-ethyl-N-methylanilino)pyridine-2-carbonitrile
CID 115487644
(2S)-1-N-methyl-1-N-phenylpropane-1,2-diamine
CID 22689433

Frequently Asked Questions

What is the IUPAC name of 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile?
The IUPAC name of 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile (CID 130563574) is 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile is CC(N)CN(C)c1ccc(C#N)nc1.
What is the InChIKey of 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile?
The InChIKey is QLMJCIHELLPOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-8(12)7-14(2)10-4-3-9(5-11)13-6-10/h3-4,6,8H,7,12H2,1-2H3.
What are the key properties of 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile?
5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile has a molecular weight of 190.25 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-aminopropyl(methyl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 130563574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).