2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile

C14H20N4 — CID 106619252

IUPAC2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile
SMILESCCN(CC1CCCN1)c1nccc(C)c1C#N
InChIInChI=1S/C14H20N4/c1-3-18(10-12-5-4-7-16-12)14-13(9-15)11(2)6-8-17-14/h6,8,12,16H,3-5,7,10H2,1-2H3
InChIKeyNNTFKPGCOJZZKL-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.84
Rot. Bonds4

About 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile

2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile (PubChem CID 106619252) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile
PubChem CID106619252
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile
SMILESCCN(CC1CCCN1)c1nccc(C)c1C#N
InChIInChI=1S/C14H20N4/c1-3-18(10-12-5-4-7-16-12)14-13(9-15)11(2)6-8-17-14/h6,8,12,16H,3-5,7,10H2,1-2H3
InChIKeyNNTFKPGCOJZZKL-UHFFFAOYSA-N
XLogP1.84
TPSA51.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[ethyl(piperidin-2-ylmethyl)amino]pyridazine-4-carbonitrile
CID 106641792
6-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106619350
2-[propyl(pyrrolidin-2-ylmethyl)amino]pyrimidine-4-carbonitrile
CID 107552774
5-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-2-carbonitrile
CID 106619532
N-ethyl-N-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106619295
1-[ethyl(pyrrolidin-2-ylmethyl)amino]isoquinolin-7-ol
CID 106619450
N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106619257
N-ethyl-2-methyl-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline
CID 28598067
N-butyl-4-methyl-3-nitro-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106620261
4,6-dimethyl-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106618773
2-bromo-6-[ethyl(piperidin-2-ylmethyl)amino]benzonitrile
CID 106641728
3-chloro-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]pyridine-4-carbonitrile
CID 107061419

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile?
The IUPAC name of 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile (CID 106619252) is 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile is CCN(CC1CCCN1)c1nccc(C)c1C#N.
What is the InChIKey of 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile?
The InChIKey is NNTFKPGCOJZZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-3-18(10-12-5-4-7-16-12)14-13(9-15)11(2)6-8-17-14/h6,8,12,16H,3-5,7,10H2,1-2H3.
What are the key properties of 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile?
2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile has a molecular weight of 244.34 g/mol, XLogP of 1.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(pyrrolidin-2-ylmethyl)amino]-4-methylpyridine-3-carbonitrile is sourced from PubChem (CID 106619252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).