6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine

C15H18N6 — CID 62957017

IUPAC6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine
SMILESCCCn1ccnc1CNc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C15H18N6/c1-2-7-20-9-6-17-15(20)11-18-13-3-4-14(19-10-13)21-8-5-16-12-21/h3-6,8-10,12,18H,2,7,11H2,1H3
InChIKeyLMKOKVUDVFADTR-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.49
Rot. Bonds6

About 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine

6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine (PubChem CID 62957017) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine
PubChem CID62957017
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine
SMILESCCCn1ccnc1CNc1ccc(-n2ccnc2)nc1
InChIInChI=1S/C15H18N6/c1-2-7-20-9-6-17-15(20)11-18-13-3-4-14(19-10-13)21-8-5-16-12-21/h3-6,8-10,12,18H,2,7,11H2,1H3
InChIKeyLMKOKVUDVFADTR-UHFFFAOYSA-N
XLogP2.49
TPSA60.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-imidazol-1-yl-N-[(1-propylpyrrol-2-yl)methyl]pyridin-3-amine
CID 66410557
6-imidazol-1-yl-N-propylpyridin-3-amine
CID 43710767
N-benzyl-6-imidazol-1-ylpyridin-3-amine
CID 43710619
N-tert-butyl-6-imidazol-1-ylpyridin-3-amine
CID 167253831
6-imidazol-1-yl-N-[(4-methylsulfanylphenyl)methyl]pyridin-3-amine
CID 43710494
N-[4-[(1-propylimidazol-2-yl)methylamino]phenyl]acetamide
CID 62956453
6-imidazol-1-yl-N-[(1-methyltriazol-4-yl)methyl]pyridin-3-amine
CID 62756492
N-heptan-3-yl-6-imidazol-1-ylpyridin-3-amine
CID 63945117
N-[(1-propylimidazol-2-yl)methyl]-4-pyrazol-1-ylaniline
CID 62957014
N-[(1-ethylpyrazol-4-yl)methyl]-6-imidazol-1-ylpyridin-3-amine
CID 103934270
3-fluoro-4-methyl-N-[(1-propylimidazol-2-yl)methyl]aniline
CID 62957177
4-[(1-propylimidazol-2-yl)methylamino]benzenesulfonamide
CID 62957865

Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine?
The IUPAC name of 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine (CID 62957017) is 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine?
The canonical SMILES for 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine is CCCn1ccnc1CNc1ccc(-n2ccnc2)nc1.
What is the InChIKey of 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine?
The InChIKey is LMKOKVUDVFADTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-2-7-20-9-6-17-15(20)11-18-13-3-4-14(19-10-13)21-8-5-16-12-21/h3-6,8-10,12,18H,2,7,11H2,1H3.
What are the key properties of 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine?
6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine has a molecular weight of 282.35 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-N-[(1-propylimidazol-2-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 62957017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).