2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol

C10H15ClN2O — CID 165348764

IUPAC2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol
SMILESCCCC(N)C(O)c1cccc(Cl)n1
InChIInChI=1S/C10H15ClN2O/c1-2-4-7(12)10(14)8-5-3-6-9(11)13-8/h3,5-7,10,14H,2,4,12H2,1H3
InChIKeyCZZNMRZKKOYOAH-UHFFFAOYSA-N
MW214.70 g/mol
LogP1.90
Rot. Bonds4

About 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol

2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol (PubChem CID 165348764) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol.

Molecular Properties

Compound Name2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol
PubChem CID165348764
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol
SMILESCCCC(N)C(O)c1cccc(Cl)n1
InChIInChI=1S/C10H15ClN2O/c1-2-4-7(12)10(14)8-5-3-6-9(11)13-8/h3,5-7,10,14H,2,4,12H2,1H3
InChIKeyCZZNMRZKKOYOAH-UHFFFAOYSA-N
XLogP1.90
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol?
The IUPAC name of 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol (CID 165348764) is 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol.
What is the SMILES notation for 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol?
The canonical SMILES for 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol is CCCC(N)C(O)c1cccc(Cl)n1.
What is the InChIKey of 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol?
The InChIKey is CZZNMRZKKOYOAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O/c1-2-4-7(12)10(14)8-5-3-6-9(11)13-8/h3,5-7,10,14H,2,4,12H2,1H3.
What are the key properties of 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol?
2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol has a molecular weight of 214.70 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(6-chloro-2-pyridinyl)pentan-1-ol is sourced from PubChem (CID 165348764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).