6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile

C13H15N3 — CID 64596117

IUPAC6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C13H15N3/c14-8-11-2-1-3-13(15-11)16(12-6-7-12)9-10-4-5-10/h1-3,10,12H,4-7,9H2
InChIKeyHFBXMWVKUFXXQT-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.33
Rot. Bonds4

About 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile

6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile (PubChem CID 64596117) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile
PubChem CID64596117
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C13H15N3/c14-8-11-2-1-3-13(15-11)16(12-6-7-12)9-10-4-5-10/h1-3,10,12H,4-7,9H2
InChIKeyHFBXMWVKUFXXQT-UHFFFAOYSA-N
XLogP2.33
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile?
The IUPAC name of 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile (CID 64596117) is 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile is N#Cc1cccc(N(CC2CC2)C2CC2)n1.
What is the InChIKey of 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile?
The InChIKey is HFBXMWVKUFXXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c14-8-11-2-1-3-13(15-11)16(12-6-7-12)9-10-4-5-10/h1-3,10,12H,4-7,9H2.
What are the key properties of 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile?
6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile has a molecular weight of 213.28 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[cyclopropyl(cyclopropylmethyl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 64596117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).