4-(aminomethyl)-N-cyclopropylpyridin-2-amine

C9H13N3 — CID 62104174

IUPAC4-(aminomethyl)-N-cyclopropylpyridin-2-amine
SMILESNCc1ccnc(NC2CC2)c1
InChIInChI=1S/C9H13N3/c10-6-7-3-4-11-9(5-7)12-8-1-2-8/h3-5,8H,1-2,6,10H2,(H,11,12)
InChIKeyFRBPCIAHMXDUDZ-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.11
Rot. Bonds3

About 4-(aminomethyl)-N-cyclopropylpyridin-2-amine

4-(aminomethyl)-N-cyclopropylpyridin-2-amine (PubChem CID 62104174) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 4-(aminomethyl)-N-cyclopropylpyridin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-cyclopropylpyridin-2-amine
PubChem CID62104174
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name4-(aminomethyl)-N-cyclopropylpyridin-2-amine
SMILESNCc1ccnc(NC2CC2)c1
InChIInChI=1S/C9H13N3/c10-6-7-3-4-11-9(5-7)12-8-1-2-8/h3-5,8H,1-2,6,10H2,(H,11,12)
InChIKeyFRBPCIAHMXDUDZ-UHFFFAOYSA-N
XLogP1.11
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-cyclopropylpyridin-2-amine?
The IUPAC name of 4-(aminomethyl)-N-cyclopropylpyridin-2-amine (CID 62104174) is 4-(aminomethyl)-N-cyclopropylpyridin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-cyclopropylpyridin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-cyclopropylpyridin-2-amine is NCc1ccnc(NC2CC2)c1.
What is the InChIKey of 4-(aminomethyl)-N-cyclopropylpyridin-2-amine?
The InChIKey is FRBPCIAHMXDUDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c10-6-7-3-4-11-9(5-7)12-8-1-2-8/h3-5,8H,1-2,6,10H2,(H,11,12).
What are the key properties of 4-(aminomethyl)-N-cyclopropylpyridin-2-amine?
4-(aminomethyl)-N-cyclopropylpyridin-2-amine has a molecular weight of 163.22 g/mol, XLogP of 1.11, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-cyclopropylpyridin-2-amine is sourced from PubChem (CID 62104174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).