6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile

C14H20N4 — CID 79719387

IUPAC6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile
SMILESCCN(CC1CCNCC1)c1ccc(C#N)cn1
InChIInChI=1S/C14H20N4/c1-2-18(11-12-5-7-16-8-6-12)14-4-3-13(9-15)10-17-14/h3-4,10,12,16H,2,5-8,11H2,1H3
InChIKeyYSIFYKUGRXPHLG-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.78
Rot. Bonds4

About 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile

6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile (PubChem CID 79719387) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile
PubChem CID79719387
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile
SMILESCCN(CC1CCNCC1)c1ccc(C#N)cn1
InChIInChI=1S/C14H20N4/c1-2-18(11-12-5-7-16-8-6-12)14-4-3-13(9-15)10-17-14/h3-4,10,12,16H,2,5-8,11H2,1H3
InChIKeyYSIFYKUGRXPHLG-UHFFFAOYSA-N
XLogP1.78
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 ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[piperidin-4-ylmethyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 79719998
6-[ethyl(pyrrolidin-2-ylmethyl)amino]pyridine-3-carbonitrile
CID 106619350
2-[ethyl(piperidin-4-ylmethyl)amino]-6-methylpyridine-4-carbonitrile
CID 114770166
2-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile
CID 79719604
N,6-diethyl-2-methyl-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 79720099
2-[ethyl(piperidin-4-ylmethyl)amino]-3-nitropyridine-4-carbonitrile
CID 82795332
6-[azetidin-3-yl(propyl)amino]pyridine-3-carbonitrile
CID 66214140
6-[(3,5-diethoxyphenyl)methyl-piperidin-4-ylamino]pyridine-3-carbonitrile
CID 68862540
tert-butyl-[2-[(5-cyano-2-pyridinyl)-ethylamino]ethyl]carbamic acid
CID 175931430
4-cyano-N-ethyl-N-(piperidin-4-ylmethyl)benzenesulfonamide
CID 79702963
6-[cyclobutyl(methyl)amino]pyridine-3-carbonitrile
CID 115650122
4-[[6-[ethyl(piperidin-4-ylmethyl)amino]pyrimidin-4-yl]amino]-2,5-difluorobenzonitrile
CID 68981951

Frequently Asked Questions

What is the IUPAC name of 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile (CID 79719387) is 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile is CCN(CC1CCNCC1)c1ccc(C#N)cn1.
What is the InChIKey of 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile?
The InChIKey is YSIFYKUGRXPHLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-2-18(11-12-5-7-16-8-6-12)14-4-3-13(9-15)10-17-14/h3-4,10,12,16H,2,5-8,11H2,1H3.
What are the key properties of 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile?
6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile has a molecular weight of 244.34 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[ethyl(piperidin-4-ylmethyl)amino]pyridine-3-carbonitrile is sourced from PubChem (CID 79719387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).