6-chloro-N-(3-ethoxypropyl)pyridin-2-amine

C10H15ClN2O — CID 53410274

IUPAC6-chloro-N-(3-ethoxypropyl)pyridin-2-amine
SMILESCCOCCCNc1cccc(Cl)n1
InChIInChI=1S/C10H15ClN2O/c1-2-14-8-4-7-12-10-6-3-5-9(11)13-10/h3,5-6H,2,4,7-8H2,1H3,(H,12,13)
InChIKeyQBKSAWLGRWGXOQ-UHFFFAOYSA-N
MW214.70 g/mol
LogP2.57
Rot. Bonds6

About 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine

6-chloro-N-(3-ethoxypropyl)pyridin-2-amine (PubChem CID 53410274) has the molecular formula C10H15ClN2O and a molecular weight of 214.70 g/mol. Its IUPAC name is 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(3-ethoxypropyl)pyridin-2-amine
PubChem CID53410274
Molecular FormulaC10H15ClN2O
Molecular Weight214.70 g/mol
Exact Mass214.09
IUPAC Name6-chloro-N-(3-ethoxypropyl)pyridin-2-amine
SMILESCCOCCCNc1cccc(Cl)n1
InChIInChI=1S/C10H15ClN2O/c1-2-14-8-4-7-12-10-6-3-5-9(11)13-10/h3,5-6H,2,4,7-8H2,1H3,(H,12,13)
InChIKeyQBKSAWLGRWGXOQ-UHFFFAOYSA-N
XLogP2.57
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-[2-[2-[2-[(6-chloro-2-pyridinyl)amino]ethoxy]ethoxy]ethyl]pyridin-2-amine
CID 101398050
N'-(6-chloro-2-pyridinyl)butane-1,4-diamine
CID 117097392
6-chloro-N-(3-ethoxypropyl)-2-(methoxymethyl)pyrimidin-4-amine
CID 82463136
6-chloro-N-(3-ethoxypropyl)pyrimidin-4-amine
CID 53410275
6-chloro-N-(7-methyloctyl)pyridin-2-amine
CID 107817529
6-chloro-2-(ethoxymethyl)-N-(3-ethoxypropyl)pyrimidin-4-amine
CID 113400806
6-bromo-N-(2-ethoxyethyl)pyridin-2-amine
CID 63962795
6-ethoxy-N-(3-methoxypropyl)pyridin-2-amine
CID 63590219
N-(3-ethoxypropyl)-2-hydrazinylpyrimidin-4-amine
CID 80944662
2-[3-[(6-methoxy-2-pyridinyl)amino]propoxy]ethanol
CID 106307016
6-N-(3-methoxypropyl)pyridine-2,6-diamine
CID 80647839
6-bromo-N-(3-methoxypropyl)pyridin-2-amine
CID 46739391

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine (CID 53410274) is 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine is CCOCCCNc1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine?
The InChIKey is QBKSAWLGRWGXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O/c1-2-14-8-4-7-12-10-6-3-5-9(11)13-10/h3,5-6H,2,4,7-8H2,1H3,(H,12,13).
What are the key properties of 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine?
6-chloro-N-(3-ethoxypropyl)pyridin-2-amine has a molecular weight of 214.70 g/mol, XLogP of 2.57, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-ethoxypropyl)pyridin-2-amine is sourced from PubChem (CID 53410274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).