3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine

C13H21N3 — CID 64664363

IUPAC3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(CC(C)CNC2CC2)c1
InChIInChI=1S/C13H21N3/c1-9(7-15-12-3-4-12)5-11-6-10(2)8-16-13(11)14/h6,8-9,12,15H,3-5,7H2,1-2H3,(H2,14,16)
InChIKeyBHRBPZKPVFREQC-UHFFFAOYSA-N
MW219.33 g/mol
LogP1.90
Rot. Bonds5

About 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine

3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine (PubChem CID 64664363) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine
PubChem CID64664363
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(CC(C)CNC2CC2)c1
InChIInChI=1S/C13H21N3/c1-9(7-15-12-3-4-12)5-11-6-10(2)8-16-13(11)14/h6,8-9,12,15H,3-5,7H2,1-2H3,(H2,14,16)
InChIKeyBHRBPZKPVFREQC-UHFFFAOYSA-N
XLogP1.90
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine?
The IUPAC name of 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine (CID 64664363) is 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine.
What is the SMILES notation for 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine?
The canonical SMILES for 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine is Cc1cnc(N)c(CC(C)CNC2CC2)c1.
What is the InChIKey of 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine?
The InChIKey is BHRBPZKPVFREQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-9(7-15-12-3-4-12)5-11-6-10(2)8-16-13(11)14/h6,8-9,12,15H,3-5,7H2,1-2H3,(H2,14,16).
What are the key properties of 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine?
3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine has a molecular weight of 219.33 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(cyclopropylamino)-2-methylpropyl]-5-methylpyridin-2-amine is sourced from PubChem (CID 64664363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).