1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine

C14H20N4 — CID 66161982

IUPAC1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine
SMILESCc1ccc(CNCc2cncn2C(C)C)cn1
InChIInChI=1S/C14H20N4/c1-11(2)18-10-16-9-14(18)8-15-6-13-5-4-12(3)17-7-13/h4-5,7,9-11,15H,6,8H2,1-3H3
InChIKeyDXZCMYNBTQOUIO-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.46
Rot. Bonds5

About 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine

1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine (PubChem CID 66161982) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine
PubChem CID66161982
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine
SMILESCc1ccc(CNCc2cncn2C(C)C)cn1
InChIInChI=1S/C14H20N4/c1-11(2)18-10-16-9-14(18)8-15-6-13-5-4-12(3)17-7-13/h4-5,7,9-11,15H,6,8H2,1-3H3
InChIKeyDXZCMYNBTQOUIO-UHFFFAOYSA-N
XLogP2.46
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-methoxy-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine
CID 66129481
N-[(3-propan-2-ylimidazol-4-yl)methyl]-1-pyridin-3-ylmethanamine
CID 66131281
N-methyl-4-[[(3-propan-2-ylimidazol-4-yl)methylamino]methyl]benzamide
CID 66130279
1-(6-methyl-3-pyridinyl)-N-[(2-phenyltriazol-4-yl)methyl]methanamine
CID 62405326
N'-[(3-propan-2-ylimidazol-4-yl)methyl]propane-1,3-diamine
CID 66132307
4-methyl-N-[(3-propan-2-ylimidazol-4-yl)methyl]aniline
CID 66129675
N-(1,3-benzothiazol-2-ylmethyl)-1-(3-propan-2-ylimidazol-4-yl)methanamine
CID 66130680
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-1-(3-propan-2-ylimidazol-4-yl)methanamine
CID 114179966
N'-[(3-propan-2-ylimidazol-4-yl)methyl]butane-1,4-diamine
CID 66132309
3-phenoxy-N-[(3-propan-2-ylimidazol-4-yl)methyl]propan-1-amine
CID 66163380
1-(6-methyl-3-pyridinyl)-N-[(1-methylpyrrol-3-yl)methyl]methanamine
CID 66398571
3-methyl-4-[(3-propan-2-ylimidazol-4-yl)methylamino]butan-1-ol
CID 66164185

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine?
The IUPAC name of 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine (CID 66161982) is 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine?
The canonical SMILES for 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine is Cc1ccc(CNCc2cncn2C(C)C)cn1.
What is the InChIKey of 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine?
The InChIKey is DXZCMYNBTQOUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-11(2)18-10-16-9-14(18)8-15-6-13-5-4-12(3)17-7-13/h4-5,7,9-11,15H,6,8H2,1-3H3.
What are the key properties of 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine?
1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine has a molecular weight of 244.34 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methyl-3-pyridinyl)-N-[(3-propan-2-ylimidazol-4-yl)methyl]methanamine is sourced from PubChem (CID 66161982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).