3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine

C14H21Cl2N3 — CID 102758185

IUPAC3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine
SMILESCCCNc1nc(N2CCCC2(C)C)c(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N3/c1-4-7-17-12-10(15)9-11(16)13(18-12)19-8-5-6-14(19,2)3/h9H,4-8H2,1-3H3,(H,17,18)
InChIKeyIUACLEPEYUPNEB-UHFFFAOYSA-N
MW302.25 g/mol
LogP4.59
Rot. Bonds4

About 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine

3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine (PubChem CID 102758185) has the molecular formula C14H21Cl2N3 and a molecular weight of 302.25 g/mol. Its IUPAC name is 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine
PubChem CID102758185
Molecular FormulaC14H21Cl2N3
Molecular Weight302.25 g/mol
Exact Mass301.11
IUPAC Name3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine
SMILESCCCNc1nc(N2CCCC2(C)C)c(Cl)cc1Cl
InChIInChI=1S/C14H21Cl2N3/c1-4-7-17-12-10(15)9-11(16)13(18-12)19-8-5-6-14(19,2)3/h9H,4-8H2,1-3H3,(H,17,18)
InChIKeyIUACLEPEYUPNEB-UHFFFAOYSA-N
XLogP4.59
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.25
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine (CID 102758185) is 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine is CCCNc1nc(N2CCCC2(C)C)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine?
The InChIKey is IUACLEPEYUPNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21Cl2N3/c1-4-7-17-12-10(15)9-11(16)13(18-12)19-8-5-6-14(19,2)3/h9H,4-8H2,1-3H3,(H,17,18).
What are the key properties of 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine?
3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine has a molecular weight of 302.25 g/mol, XLogP of 4.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(2,2-dimethylpyrrolidin-1-yl)-N-propylpyridin-2-amine is sourced from PubChem (CID 102758185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).