6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine

C16H20N4O — CID 62323028

IUPAC6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
SMILESCc1cccc(CNc2ccc(N)c(OCC3CC3)n2)n1
InChIInChI=1S/C16H20N4O/c1-11-3-2-4-13(19-11)9-18-15-8-7-14(17)16(20-15)21-10-12-5-6-12/h2-4,7-8,12H,5-6,9-10,17H2,1H3,(H,18,20)
InChIKeyUSBYEMNNPXEUNI-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.77
Rot. Bonds6

About 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine

6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine (PubChem CID 62323028) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
PubChem CID62323028
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
SMILESCc1cccc(CNc2ccc(N)c(OCC3CC3)n2)n1
InChIInChI=1S/C16H20N4O/c1-11-3-2-4-13(19-11)9-18-15-8-7-14(17)16(20-15)21-10-12-5-6-12/h2-4,7-8,12H,5-6,9-10,17H2,1H3,(H,18,20)
InChIKeyUSBYEMNNPXEUNI-UHFFFAOYSA-N
XLogP2.77
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine?
The IUPAC name of 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine (CID 62323028) is 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine is Cc1cccc(CNc2ccc(N)c(OCC3CC3)n2)n1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine?
The InChIKey is USBYEMNNPXEUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-3-2-4-13(19-11)9-18-15-8-7-14(17)16(20-15)21-10-12-5-6-12/h2-4,7-8,12H,5-6,9-10,17H2,1H3,(H,18,20).
What are the key properties of 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine?
6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine has a molecular weight of 284.36 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 62323028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).