5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine

C12H18ClN3 — CID 61170004

IUPAC5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine
SMILESCCN1CCCC(Nc2ccc(Cl)cn2)C1
InChIInChI=1S/C12H18ClN3/c1-2-16-7-3-4-11(9-16)15-12-6-5-10(13)8-14-12/h5-6,8,11H,2-4,7,9H2,1H3,(H,14,15)
InChIKeyDBGAYTNXRISFAV-UHFFFAOYSA-N
MW239.75 g/mol
LogP2.63
Rot. Bonds3

About 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine

5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine (PubChem CID 61170004) has the molecular formula C12H18ClN3 and a molecular weight of 239.75 g/mol. Its IUPAC name is 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine
PubChem CID61170004
Molecular FormulaC12H18ClN3
Molecular Weight239.75 g/mol
Exact Mass239.12
IUPAC Name5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine
SMILESCCN1CCCC(Nc2ccc(Cl)cn2)C1
InChIInChI=1S/C12H18ClN3/c1-2-16-7-3-4-11(9-16)15-12-6-5-10(13)8-14-12/h5-6,8,11H,2-4,7,9H2,1H3,(H,14,15)
InChIKeyDBGAYTNXRISFAV-UHFFFAOYSA-N
XLogP2.63
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethylpiperidin-3-yl)-5-fluoropyridin-2-amine
CID 61313341
5-chloro-N-cyclobutylpyridin-2-amine
CID 62414394
N-(1-ethylpiperidin-3-yl)-5,6-dimethylpyrazin-2-amine
CID 114475474
N-(1-ethylpiperidin-3-yl)-2-methylpyrimidin-4-amine
CID 62786064
(3R)-3-[(5-chloro-2-pyridinyl)amino]pyrrolidine-1-carboxylic acid
CID 175114110
N-(4-chlorophenyl)-1-ethylpyrrolidin-3-amine
CID 154333311
5-chloro-4-N-(1-ethylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80800762
2-N-(1-ethylpiperidin-3-yl)-6-N-propylpyrazine-2,6-diamine
CID 80800932
N-(5-chloro-2-pyridinyl)-2-[(3R)-3-hydroxypiperidin-1-yl]acetamide
CID 94184594
4-N-(1-ethylpiperidin-3-yl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114564466
N-(5-chloro-2-pyridinyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 4692251
N-[1-(4-chlorophenyl)propyl]-1-ethylpiperidin-3-amine
CID 61171924

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine (CID 61170004) is 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine is CCN1CCCC(Nc2ccc(Cl)cn2)C1.
What is the InChIKey of 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine?
The InChIKey is DBGAYTNXRISFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18ClN3/c1-2-16-7-3-4-11(9-16)15-12-6-5-10(13)8-14-12/h5-6,8,11H,2-4,7,9H2,1H3,(H,14,15).
What are the key properties of 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine?
5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine has a molecular weight of 239.75 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(1-ethylpiperidin-3-yl)pyridin-2-amine is sourced from PubChem (CID 61170004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).