5-chloro-2-N-cyclopentylpyridine-2,3-diamine

C10H14ClN3 — CID 58171612

IUPAC5-chloro-2-N-cyclopentylpyridine-2,3-diamine
SMILESNc1cc(Cl)cnc1NC1CCCC1
InChIInChI=1S/C10H14ClN3/c11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8/h5-6,8H,1-4,12H2,(H,13,14)
InChIKeyFDVGJASVZDZUTO-UHFFFAOYSA-N
MW211.70 g/mol
LogP2.67
Rot. Bonds2

About 5-chloro-2-N-cyclopentylpyridine-2,3-diamine

5-chloro-2-N-cyclopentylpyridine-2,3-diamine (PubChem CID 58171612) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 5-chloro-2-N-cyclopentylpyridine-2,3-diamine.

Molecular Properties

Compound Name5-chloro-2-N-cyclopentylpyridine-2,3-diamine
PubChem CID58171612
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name5-chloro-2-N-cyclopentylpyridine-2,3-diamine
SMILESNc1cc(Cl)cnc1NC1CCCC1
InChIInChI=1S/C10H14ClN3/c11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8/h5-6,8H,1-4,12H2,(H,13,14)
InChIKeyFDVGJASVZDZUTO-UHFFFAOYSA-N
XLogP2.67
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-N-cyclopentylpyridine-2,3-diamine?
The IUPAC name of 5-chloro-2-N-cyclopentylpyridine-2,3-diamine (CID 58171612) is 5-chloro-2-N-cyclopentylpyridine-2,3-diamine.
What is the SMILES notation for 5-chloro-2-N-cyclopentylpyridine-2,3-diamine?
The canonical SMILES for 5-chloro-2-N-cyclopentylpyridine-2,3-diamine is Nc1cc(Cl)cnc1NC1CCCC1.
What is the InChIKey of 5-chloro-2-N-cyclopentylpyridine-2,3-diamine?
The InChIKey is FDVGJASVZDZUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3/c11-7-5-9(12)10(13-6-7)14-8-3-1-2-4-8/h5-6,8H,1-4,12H2,(H,13,14).
What are the key properties of 5-chloro-2-N-cyclopentylpyridine-2,3-diamine?
5-chloro-2-N-cyclopentylpyridine-2,3-diamine has a molecular weight of 211.70 g/mol, XLogP of 2.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-N-cyclopentylpyridine-2,3-diamine is sourced from PubChem (CID 58171612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).