6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine

C10H15ClN4 — CID 123942355

IUPAC6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1NC1CCNCC1
InChIInChI=1S/C10H15ClN4/c11-9-2-1-8(12)10(15-9)14-7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2,(H,14,15)
InChIKeyDPHAQIMFHQLMAM-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.48
Rot. Bonds2

About 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine

6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine (PubChem CID 123942355) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine.

Molecular Properties

Compound Name6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine
PubChem CID123942355
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1NC1CCNCC1
InChIInChI=1S/C10H15ClN4/c11-9-2-1-8(12)10(15-9)14-7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2,(H,14,15)
InChIKeyDPHAQIMFHQLMAM-UHFFFAOYSA-N
XLogP1.48
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-2-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2,3-diamine
CID 103965270
6-chloro-2-piperidin-4-ylpyridin-3-amine
CID 169253686
6-chloro-2-N-piperidin-4-ylpyridine-2,4-diamine
CID 115035891
2-chloro-4-N-piperidin-4-ylbenzene-1,4-diamine
CID 89025318
6-chloro-N-piperidin-4-ylthieno[3,2-c]pyridin-4-amine;dihydrochloride
CID 87855093
5-fluoro-1-N-piperidin-4-ylisoquinoline-1,8-diamine
CID 82570043
6-chloro-2-N-(3,4-dihydro-2H-chromen-4-yl)pyridine-2,3-diamine
CID 115474076
2-chloro-5-fluoro-N-piperidin-4-ylpyrimidin-4-amine
CID 59210379
2-N-piperidin-4-ylpyrimidine-2,4-diamine
CID 70341229
5-amino-6-[(4-methylcyclohexyl)amino]pyridine-2-carboxamide
CID 104963536
2-chloro-5-N-methyl-4-N-piperidin-4-ylpyrimidine-4,5-diamine
CID 146275528
[6-chloro-2-(cyclopentylamino)-3-pyridinyl]methanol
CID 155458622

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine?
The IUPAC name of 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine (CID 123942355) is 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine.
What is the SMILES notation for 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine?
The canonical SMILES for 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine is Nc1ccc(Cl)nc1NC1CCNCC1.
What is the InChIKey of 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine?
The InChIKey is DPHAQIMFHQLMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c11-9-2-1-8(12)10(15-9)14-7-3-5-13-6-4-7/h1-2,7,13H,3-6,12H2,(H,14,15).
What are the key properties of 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine?
6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine has a molecular weight of 226.71 g/mol, XLogP of 1.48, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-N-piperidin-4-ylpyridine-2,3-diamine is sourced from PubChem (CID 123942355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).