2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine

C9H13N3 — CID 43264702

IUPAC2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine
SMILESCN(c1ncccc1N)C1CC1
InChIInChI=1S/C9H13N3/c1-12(7-4-5-7)9-8(10)3-2-6-11-9/h2-3,6-7H,4-5,10H2,1H3
InChIKeyFVOGLPQKFJUQIG-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.26
Rot. Bonds2

About 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine

2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine (PubChem CID 43264702) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine
PubChem CID43264702
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine
SMILESCN(c1ncccc1N)C1CC1
InChIInChI=1S/C9H13N3/c1-12(7-4-5-7)9-8(10)3-2-6-11-9/h2-3,6-7H,4-5,10H2,1H3
InChIKeyFVOGLPQKFJUQIG-UHFFFAOYSA-N
XLogP1.26
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine?
The IUPAC name of 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine (CID 43264702) is 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine?
The canonical SMILES for 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine is CN(c1ncccc1N)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine?
The InChIKey is FVOGLPQKFJUQIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c1-12(7-4-5-7)9-8(10)3-2-6-11-9/h2-3,6-7H,4-5,10H2,1H3.
What are the key properties of 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine?
2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine has a molecular weight of 163.22 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-2-N-methylpyridine-2,3-diamine is sourced from PubChem (CID 43264702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).