5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine

C11H15N5 — CID 63013748

IUPAC5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
SMILESCN(Cc1nccn1C)c1ccc(N)nc1
InChIInChI=1S/C11H15N5/c1-15-6-5-13-11(15)8-16(2)9-3-4-10(12)14-7-9/h3-7H,8H2,1-2H3,(H2,12,14)
InChIKeyLKTDOEDGSMPTID-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.03
Rot. Bonds3

About 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine

5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine (PubChem CID 63013748) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
PubChem CID63013748
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine
SMILESCN(Cc1nccn1C)c1ccc(N)nc1
InChIInChI=1S/C11H15N5/c1-15-6-5-13-11(15)8-16(2)9-3-4-10(12)14-7-9/h3-7H,8H2,1-2H3,(H2,12,14)
InChIKeyLKTDOEDGSMPTID-UHFFFAOYSA-N
XLogP1.03
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1S)-1-[5-[methyl-[(1-methylimidazol-2-yl)methyl]amino]-2-pyridinyl]propan-1-ol
CID 103938734
4-[(1R)-1-aminoethyl]-N-methyl-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 78935414
4-(chloromethyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]aniline
CID 63013979
6-[1-(ethylamino)ethyl]-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridin-3-amine
CID 83127053
5-amino-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrazine-2-carboxamide
CID 113383759
3-N-methyl-3-N-[(1-methylimidazol-2-yl)methyl]-5-propan-2-yloxybenzene-1,3-diamine
CID 80736074
4-N-methyl-4-N-[(1-methylimidazol-2-yl)methyl]-1H-pyrazole-4,5-diamine
CID 82237860
4-[methyl-[(1-methylimidazol-2-yl)methyl]amino]pyridine-2-carbonitrile
CID 55151643
4-bromo-1-N-methyl-1-N-[(1-methylimidazol-2-yl)methyl]benzene-1,2-diamine
CID 63013204
4-(aminomethyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyrimidin-2-amine
CID 107541978
5-N-methyl-5-N-(thiophen-2-ylmethyl)pyridine-2,5-diamine
CID 43527362
6-N-methyl-6-N-[(1-methylimidazol-2-yl)methyl]isoquinoline-5,6-diamine
CID 106948056

Frequently Asked Questions

What is the IUPAC name of 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The IUPAC name of 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine (CID 63013748) is 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine is CN(Cc1nccn1C)c1ccc(N)nc1.
What is the InChIKey of 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
The InChIKey is LKTDOEDGSMPTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-15-6-5-13-11(15)8-16(2)9-3-4-10(12)14-7-9/h3-7H,8H2,1-2H3,(H2,12,14).
What are the key properties of 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine?
5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine has a molecular weight of 217.28 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-methyl-5-N-[(1-methylimidazol-2-yl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 63013748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).