N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine

C14H15ClN2O — CID 133390134

IUPACN-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine
SMILESClc1ccc(COCCNc2ccccn2)cc1
InChIInChI=1S/C14H15ClN2O/c15-13-6-4-12(5-7-13)11-18-10-9-17-14-3-1-2-8-16-14/h1-8H,9-11H2,(H,16,17)
InChIKeyDZMVEILJPAVJDP-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.36
Rot. Bonds6

About N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine

N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine (PubChem CID 133390134) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine.

Molecular Properties

Compound NameN-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine
PubChem CID133390134
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC NameN-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine
SMILESClc1ccc(COCCNc2ccccn2)cc1
InChIInChI=1S/C14H15ClN2O/c15-13-6-4-12(5-7-13)11-18-10-9-17-14-3-1-2-8-16-14/h1-8H,9-11H2,(H,16,17)
InChIKeyDZMVEILJPAVJDP-UHFFFAOYSA-N
XLogP3.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[(4-methoxyphenyl)methoxy]ethyl]pyridin-2-amine
CID 133444680
5-bromo-N-[2-[(4-chlorophenyl)methoxy]ethyl]pyrimidin-2-amine
CID 133390150
N-[2-[(4-chlorophenyl)methoxy]ethyl]-4,6-dimethylpyrimidin-2-amine
CID 133390142
6-chloro-4-N-(2-phenylmethoxyethyl)pyrimidine-2,4-diamine
CID 155896810
N-[2-[(4-chlorophenyl)methoxy]ethyl]-1,7-naphthyridin-4-amine
CID 166183159
N-(3-chloropropyl)pyridin-2-amine
CID 22118637
N-[2-[(4-chlorophenyl)methoxy]ethyl]-3-methylaniline
CID 65125666
N,N'-dipyridin-2-ylnonane-1,9-diamine
CID 86213861
2-(pyridin-2-ylamino)ethyl hydrogen carbonate
CID 91086886
N-[(3-chloro-4-fluorophenyl)methyl]pyridin-2-amine
CID 62537645
N-(4-chlorobutyl)pyridin-2-amine
CID 106845032
N-(3-butoxypropyl)pyridin-2-amine
CID 115569614

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine?
The IUPAC name of N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine (CID 133390134) is N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine.
What is the SMILES notation for N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine?
The canonical SMILES for N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine is Clc1ccc(COCCNc2ccccn2)cc1.
What is the InChIKey of N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine?
The InChIKey is DZMVEILJPAVJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c15-13-6-4-12(5-7-13)11-18-10-9-17-14-3-1-2-8-16-14/h1-8H,9-11H2,(H,16,17).
What are the key properties of N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine?
N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine has a molecular weight of 262.74 g/mol, XLogP of 3.36, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-chlorophenyl)methoxy]ethyl]pyridin-2-amine is sourced from PubChem (CID 133390134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).