5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine

C11H15ClN2 — CID 115658742

IUPAC5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine
SMILESCC(CNc1ccc(Cl)cn1)C1CC1
InChIInChI=1S/C11H15ClN2/c1-8(9-2-3-9)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14)
InChIKeySKPGHGNOQYKDRS-UHFFFAOYSA-N
MW210.71 g/mol
LogP3.19
Rot. Bonds4

About 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine

5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine (PubChem CID 115658742) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine
PubChem CID115658742
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine
SMILESCC(CNc1ccc(Cl)cn1)C1CC1
InChIInChI=1S/C11H15ClN2/c1-8(9-2-3-9)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14)
InChIKeySKPGHGNOQYKDRS-UHFFFAOYSA-N
XLogP3.19
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine (CID 115658742) is 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine is CC(CNc1ccc(Cl)cn1)C1CC1.
What is the InChIKey of 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine?
The InChIKey is SKPGHGNOQYKDRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-8(9-2-3-9)6-13-11-5-4-10(12)7-14-11/h4-5,7-9H,2-3,6H2,1H3,(H,13,14).
What are the key properties of 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine?
5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine has a molecular weight of 210.71 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-cyclopropylpropyl)pyridin-2-amine is sourced from PubChem (CID 115658742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).