5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine

C11H18ClN3O — CID 79198131

IUPAC5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine
SMILESCNC(c1cc(Cl)cnc1N)C(C)(C)OC
InChIInChI=1S/C11H18ClN3O/c1-11(2,16-4)9(14-3)8-5-7(12)6-15-10(8)13/h5-6,9,14H,1-4H3,(H2,13,15)
InChIKeyPYHRVUJWPRTJFV-UHFFFAOYSA-N
MW243.74 g/mol
LogP2.00
Rot. Bonds4

About 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine

5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine (PubChem CID 79198131) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine
PubChem CID79198131
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine
SMILESCNC(c1cc(Cl)cnc1N)C(C)(C)OC
InChIInChI=1S/C11H18ClN3O/c1-11(2,16-4)9(14-3)8-5-7(12)6-15-10(8)13/h5-6,9,14H,1-4H3,(H2,13,15)
InChIKeyPYHRVUJWPRTJFV-UHFFFAOYSA-N
XLogP2.00
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-amino-5-chloro-3-pyridinyl)-2-N,2-N-diethyl-1-N,2-dimethylbutane-1,2-diamine
CID 79068671
5-chloro-3-(1-hydrazinyl-2-methoxy-2-methylbutyl)pyridin-2-amine
CID 105274490
5-chloro-3-[(6-methoxypyrimidin-4-yl)-(methylamino)methyl]pyridin-2-amine
CID 102951299
(1R)-1-(4-chloro-2-pyridinyl)-2-methoxy-N,2-dimethylpropan-1-amine
CID 175806193
5-chloro-3-(1-hydrazinyl-2-methyl-2-pyrrolidin-1-ylpropyl)pyridin-2-amine
CID 105239648
5-chloro-3-[2-ethoxy-1-(methylamino)propyl]pyridin-2-amine
CID 64539853
3-(1-amino-2-methoxypropyl)-5-chloropyridin-2-amine
CID 79615951
1-(2-amino-5-chloro-3-pyridinyl)-2-N,2-N-diethyl-2-methylpropane-1,2-diamine
CID 79052761
5-chloro-3-[(3,4-dichlorophenyl)-(methylamino)methyl]pyridin-2-amine
CID 81492008
5-chloro-3-(1-hydrazinyl-3-methoxypropyl)pyridin-2-amine
CID 105206436
3-(1-amino-2-methoxy-2-methylpropyl)-5-methylpyridin-2-amine
CID 79198235
3-[(5-bromo-2-fluorophenyl)-(methylamino)methyl]-5-chloropyridin-2-amine
CID 114894706

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine?
The IUPAC name of 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine (CID 79198131) is 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine is CNC(c1cc(Cl)cnc1N)C(C)(C)OC.
What is the InChIKey of 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine?
The InChIKey is PYHRVUJWPRTJFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O/c1-11(2,16-4)9(14-3)8-5-7(12)6-15-10(8)13/h5-6,9,14H,1-4H3,(H2,13,15).
What are the key properties of 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine?
5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine has a molecular weight of 243.74 g/mol, XLogP of 2.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-[2-methoxy-2-methyl-1-(methylamino)propyl]pyridin-2-amine is sourced from PubChem (CID 79198131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).