5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine

C13H19ClN2O — CID 135114005

IUPAC5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine
SMILESCN(CCC1CCCCO1)c1ccc(Cl)cn1
InChIInChI=1S/C13H19ClN2O/c1-16(13-6-5-11(14)10-15-13)8-7-12-4-2-3-9-17-12/h5-6,10,12H,2-4,7-9H2,1H3
InChIKeyPYWKYAHIPVWXCQ-UHFFFAOYSA-N
MW254.76 g/mol
LogP3.13
Rot. Bonds4

About 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine

5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine (PubChem CID 135114005) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine
PubChem CID135114005
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC Name5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine
SMILESCN(CCC1CCCCO1)c1ccc(Cl)cn1
InChIInChI=1S/C13H19ClN2O/c1-16(13-6-5-11(14)10-15-13)8-7-12-4-2-3-9-17-12/h5-6,10,12H,2-4,7-9H2,1H3
InChIKeyPYWKYAHIPVWXCQ-UHFFFAOYSA-N
XLogP3.13
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-[2-[(2R)-oxan-2-yl]ethyl]pyridin-2-amine
CID 26396539
5-methoxy-N-methyl-N-[2-(oxan-2-yl)ethyl]pyrimidin-2-amine
CID 134700994
6-methoxy-N-methyl-N-[2-[(2R)-oxan-2-yl]ethyl]pyrimidin-4-amine
CID 95147920
5-(bromomethyl)-N-methyl-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 107081253
N-methyl-5-nitro-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 133271782
N-[(6-chloroquinolin-2-yl)methyl]-N-methyl-1-(oxan-2-yl)methanamine
CID 77080814
4-[methyl-[2-(oxolan-2-yl)ethyl]amino]benzonitrile
CID 65161052
5-chloro-N-methyl-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 79719724
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyrazin-2-amine
CID 61362605
5-(3-fluorophenyl)-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2,4-triazin-3-amine
CID 45208625
2-(4-chlorophenyl)-1-[2-(oxan-2-yl)ethyl]imidazole
CID 56865531
[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol
CID 61436346

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine (CID 135114005) is 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine is CN(CCC1CCCCO1)c1ccc(Cl)cn1.
What is the InChIKey of 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine?
The InChIKey is PYWKYAHIPVWXCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O/c1-16(13-6-5-11(14)10-15-13)8-7-12-4-2-3-9-17-12/h5-6,10,12H,2-4,7-9H2,1H3.
What are the key properties of 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine?
5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine has a molecular weight of 254.76 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-methyl-N-[2-(oxan-2-yl)ethyl]pyridin-2-amine is sourced from PubChem (CID 135114005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).