2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine

C11H18N4 — CID 117044535

IUPAC2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine
SMILESNc1ccc(NCC2CCNCC2)nc1
InChIInChI=1S/C11H18N4/c12-10-1-2-11(15-8-10)14-7-9-3-5-13-6-4-9/h1-2,8-9,13H,3-7,12H2,(H,14,15)
InChIKeyTUDPOCSNKMGCRJ-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.08
Rot. Bonds3

About 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine

2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine (PubChem CID 117044535) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine
PubChem CID117044535
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine
SMILESNc1ccc(NCC2CCNCC2)nc1
InChIInChI=1S/C11H18N4/c12-10-1-2-11(15-8-10)14-7-9-3-5-13-6-4-9/h1-2,8-9,13H,3-7,12H2,(H,14,15)
InChIKeyTUDPOCSNKMGCRJ-UHFFFAOYSA-N
XLogP1.08
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(piperidin-4-ylmethyl)pyridin-2-amine;hydrochloride
CID 71636378
N-(piperidin-4-ylmethyl)pyridin-2-amine;trihydrochloride
CID 162422883
6-(pyrrolidin-3-ylmethylamino)pyridine-3-carboxamide
CID 78990640
tert-butyl 4-[[(5-amino-2-pyridinyl)amino]methyl]piperidine-1-carboxylate
CID 53255819
2-N-(thian-2-ylmethyl)pyridine-2,5-diamine
CID 80595595
N-(cyclopropylmethyl)-5-fluoropyridin-2-amine
CID 61313730
N-[(4-aminocyclohexyl)methyl]-5-fluoropyridin-2-amine
CID 106128725
5-methyl-N-(2-piperidin-4-ylethyl)pyridin-2-amine
CID 83837473
N-(piperidin-4-ylmethyl)pyridazin-3-amine;hydrochloride
CID 69426435
2-N-cyclopropylpyridine-2,5-diamine
CID 16776026
2-N-ethylpyridine-2,5-diamine;hydrochloride
CID 134080457
N-(piperidin-4-ylmethyl)-4-propan-2-ylpyridin-2-amine
CID 126724513

Frequently Asked Questions

What is the IUPAC name of 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine?
The IUPAC name of 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine (CID 117044535) is 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine.
What is the SMILES notation for 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine?
The canonical SMILES for 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine is Nc1ccc(NCC2CCNCC2)nc1.
What is the InChIKey of 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine?
The InChIKey is TUDPOCSNKMGCRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c12-10-1-2-11(15-8-10)14-7-9-3-5-13-6-4-9/h1-2,8-9,13H,3-7,12H2,(H,14,15).
What are the key properties of 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine?
2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine has a molecular weight of 206.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(piperidin-4-ylmethyl)pyridine-2,5-diamine is sourced from PubChem (CID 117044535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).