3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine

C11H15Cl2N3 — CID 106026698

IUPAC3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
SMILESCN1CCCC1CNc1ncc(Cl)cc1Cl
InChIInChI=1S/C11H15Cl2N3/c1-16-4-2-3-9(16)7-15-11-10(13)5-8(12)6-14-11/h5-6,9H,2-4,7H2,1H3,(H,14,15)
InChIKeyFZEVNFNPWMYKOW-UHFFFAOYSA-N
MW260.17 g/mol
LogP2.89
Rot. Bonds3

About 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine

3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine (PubChem CID 106026698) has the molecular formula C11H15Cl2N3 and a molecular weight of 260.17 g/mol. Its IUPAC name is 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
PubChem CID106026698
Molecular FormulaC11H15Cl2N3
Molecular Weight260.17 g/mol
Exact Mass259.06
IUPAC Name3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
SMILESCN1CCCC1CNc1ncc(Cl)cc1Cl
InChIInChI=1S/C11H15Cl2N3/c1-16-4-2-3-9(16)7-15-11-10(13)5-8(12)6-14-11/h5-6,9H,2-4,7H2,1H3,(H,14,15)
InChIKeyFZEVNFNPWMYKOW-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.17
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine
CID 103724805
3,5-dichloro-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 60855947
3,5-dichloro-6-hydrazinyl-N-[(1-methylpiperidin-2-yl)methyl]pyridin-2-amine
CID 102761888
5-chloro-2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 114138477
5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazin-2-amine
CID 131214051
3,4-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]aniline
CID 83962864
3-chloro-5,6-dimethyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazin-2-amine
CID 106028253
3-bromo-5-chloro-N-[(1,4-dimethylpiperazin-2-yl)methyl]pyridin-2-amine
CID 114835915
5-bromo-N-[(1-methylpyrrolidin-2-yl)methyl]-3-nitropyridin-2-amine
CID 103768221
N-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-ylmethyl)-3,5-dichloropyridin-2-amine
CID 79072221
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
CID 106022717
N-cycloheptyl-N'-(3,5-dichloro-2-pyridinyl)ethane-1,2-diamine
CID 115306764

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine (CID 106026698) is 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine is CN1CCCC1CNc1ncc(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The InChIKey is FZEVNFNPWMYKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15Cl2N3/c1-16-4-2-3-9(16)7-15-11-10(13)5-8(12)6-14-11/h5-6,9H,2-4,7H2,1H3,(H,14,15).
What are the key properties of 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine?
3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine has a molecular weight of 260.17 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 106026698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).