[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine

C14H20N4O — CID 79151176

IUPAC[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine
SMILESCc1ccc(OCc2cncn2C(C)C)c(CN)n1
InChIInChI=1S/C14H20N4O/c1-10(2)18-9-16-7-12(18)8-19-14-5-4-11(3)17-13(14)6-15/h4-5,7,9-10H,6,8,15H2,1-3H3
InChIKeyYHHPDOMQFZLSFG-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.21
Rot. Bonds5

About [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine

[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine (PubChem CID 79151176) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine
PubChem CID79151176
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine
SMILESCc1ccc(OCc2cncn2C(C)C)c(CN)n1
InChIInChI=1S/C14H20N4O/c1-10(2)18-9-16-7-12(18)8-19-14-5-4-11(3)17-13(14)6-15/h4-5,7,9-10H,6,8,15H2,1-3H3
InChIKeyYHHPDOMQFZLSFG-UHFFFAOYSA-N
XLogP2.21
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 44341234
CID 44341234
CID 44341256
CID 44341256
CID 44341428
CID 44341428
CID 44341439
CID 44341439
CID 76871873
CID 76871873
CID 11172276
CID 11172276
CID 11368190
CID 11368190
CID 11368215
CID 11368215
CID 13900258
CID 13900258
CID 25169380
CID 25169380
CID 44341241
CID 44341241
CID 44341461
CID 44341461

Frequently Asked Questions

What is the IUPAC name of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine?
The IUPAC name of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine (CID 79151176) is [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine.
What is the SMILES notation for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine?
The canonical SMILES for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine is Cc1ccc(OCc2cncn2C(C)C)c(CN)n1.
What is the InChIKey of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine?
The InChIKey is YHHPDOMQFZLSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-10(2)18-9-16-7-12(18)8-19-14-5-4-11(3)17-13(14)6-15/h4-5,7,9-10H,6,8,15H2,1-3H3.
What are the key properties of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine?
[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine has a molecular weight of 260.34 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanamine is sourced from PubChem (CID 79151176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).