N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine

C15H25N3O — CID 43319584

IUPACN'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine
SMILESCOc1c(C)cnc(CN(CCCN)C2CC2)c1C
InChIInChI=1S/C15H25N3O/c1-11-9-17-14(12(2)15(11)19-3)10-18(8-4-7-16)13-5-6-13/h9,13H,4-8,10,16H2,1-3H3
InChIKeyWLOHGOSZQDIPKB-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.02
Rot. Bonds7

About N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine

N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine (PubChem CID 43319584) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine
PubChem CID43319584
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine
SMILESCOc1c(C)cnc(CN(CCCN)C2CC2)c1C
InChIInChI=1S/C15H25N3O/c1-11-9-17-14(12(2)15(11)19-3)10-18(8-4-7-16)13-5-6-13/h9,13H,4-8,10,16H2,1-3H3
InChIKeyWLOHGOSZQDIPKB-UHFFFAOYSA-N
XLogP2.02
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-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 N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine?
The IUPAC name of N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine (CID 43319584) is N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine?
The canonical SMILES for N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine is COc1c(C)cnc(CN(CCCN)C2CC2)c1C.
What is the InChIKey of N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine?
The InChIKey is WLOHGOSZQDIPKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11-9-17-14(12(2)15(11)19-3)10-18(8-4-7-16)13-5-6-13/h9,13H,4-8,10,16H2,1-3H3.
What are the key properties of N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine?
N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine has a molecular weight of 263.38 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 43319584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).