1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine

C11H16ClN3 — CID 175660028

IUPAC1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine
SMILESNC1CCN(Cc2ccc(Cl)cn2)CC1
InChIInChI=1S/C11H16ClN3/c12-9-1-2-11(14-7-9)8-15-5-3-10(13)4-6-15/h1-2,7,10H,3-6,8,13H2
InChIKeyMNPLLRQRWJJDRB-UHFFFAOYSA-N
MW225.72 g/mol
LogP1.66
Rot. Bonds2

About 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine

1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine (PubChem CID 175660028) has the molecular formula C11H16ClN3 and a molecular weight of 225.72 g/mol. Its IUPAC name is 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine
PubChem CID175660028
Molecular FormulaC11H16ClN3
Molecular Weight225.72 g/mol
Exact Mass225.10
IUPAC Name1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine
SMILESNC1CCN(Cc2ccc(Cl)cn2)CC1
InChIInChI=1S/C11H16ClN3/c12-9-1-2-11(14-7-9)8-15-5-3-10(13)4-6-15/h1-2,7,10H,3-6,8,13H2
InChIKeyMNPLLRQRWJJDRB-UHFFFAOYSA-N
XLogP1.66
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.72
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(6-chloro-3-pyridinyl)methyl]piperidin-4-amine
CID 43556713
(3S,4R)-1-[(5-chloro-2-pyridinyl)methyl]-4-phenylpiperidin-3-ol
CID 162634174
1-(pyrazin-2-ylmethyl)piperidin-4-amine
CID 43556640
3-[[1-[(5-chloro-2-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113122
5-bromo-2-[(4-fluoropiperidin-1-yl)methyl]pyridine
CID 164659359
[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 81312464
1-[(2,3-dichloro-4-fluorophenyl)methyl]piperidin-4-amine
CID 120834490
[1-[6-[4-[(5-chloro-2-pyridinyl)methyl]piperazin-1-yl]pyrimidin-4-yl]piperidin-3-yl]methanol
CID 133465663
1-(5-bromo-3-pyridinyl)-4-[(5-chloro-2-pyridinyl)methyl]piperazine
CID 133465721
(3R)-1-[(6-chloropyridazin-3-yl)methyl]pyrrolidin-3-amine
CID 71643836
2-[(4-aminopiperidin-1-yl)methyl]-7-chloropyrido[1,2-a]pyrimidin-4-one;hydrochloride
CID 119907105
N-(5-amino-1,3,4-thiadiazol-2-yl)-2-[3-[(5-chloro-2-pyridinyl)methyl]-3-azaspiro[5.5]undecan-9-yl]acetamide
CID 177337494

Frequently Asked Questions

What is the IUPAC name of 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine?
The IUPAC name of 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine (CID 175660028) is 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine?
The canonical SMILES for 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine is NC1CCN(Cc2ccc(Cl)cn2)CC1.
What is the InChIKey of 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine?
The InChIKey is MNPLLRQRWJJDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3/c12-9-1-2-11(14-7-9)8-15-5-3-10(13)4-6-15/h1-2,7,10H,3-6,8,13H2.
What are the key properties of 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine?
1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine has a molecular weight of 225.72 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-chloro-2-pyridinyl)methyl]piperidin-4-amine is sourced from PubChem (CID 175660028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).