N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine

C12H17N5 — CID 106895060

IUPACN-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESCCCn1ccnc1CNCc1cccnn1
InChIInChI=1S/C12H17N5/c1-2-7-17-8-6-14-12(17)10-13-9-11-4-3-5-15-16-11/h3-6,8,13H,2,7,9-10H2,1H3
InChIKeyKKFBROUHPRROMF-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.37
Rot. Bonds6

About N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine

N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine (PubChem CID 106895060) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine.

Molecular Properties

Compound NameN-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
PubChem CID106895060
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC NameN-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESCCCn1ccnc1CNCc1cccnn1
InChIInChI=1S/C12H17N5/c1-2-7-17-8-6-14-12(17)10-13-9-11-4-3-5-15-16-11/h3-6,8,13H,2,7,9-10H2,1H3
InChIKeyKKFBROUHPRROMF-UHFFFAOYSA-N
XLogP1.37
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106834150
1-(2-ethylphenyl)-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 64680507
1-(1-propylpyrrol-3-yl)-N-(pyridazin-3-ylmethyl)methanamine
CID 106833951
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895919
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895595
1-(2-methylpyrazol-3-yl)-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 63302358
1-naphthalen-1-yl-N-[(1-propylimidazol-2-yl)methyl]methanamine
CID 62956328
N-[(1-propylimidazol-2-yl)methyl]-1-(2H-tetrazol-5-yl)methanamine
CID 62957038
N'-[(1-propylimidazol-2-yl)methyl]ethane-1,2-diamine
CID 62957721
2-methyl-2-phenyl-N-[(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 62956494
N-[(1-propylimidazol-2-yl)methyl]-1-[3-(trifluoromethyl)phenyl]methanamine
CID 62955935
2,6-dibromo-N-[(1-propylimidazol-2-yl)methyl]aniline
CID 107597049

Frequently Asked Questions

What is the IUPAC name of N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The IUPAC name of N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine (CID 106895060) is N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine.
What is the SMILES notation for N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The canonical SMILES for N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine is CCCn1ccnc1CNCc1cccnn1.
What is the InChIKey of N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The InChIKey is KKFBROUHPRROMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-2-7-17-8-6-14-12(17)10-13-9-11-4-3-5-15-16-11/h3-6,8,13H,2,7,9-10H2,1H3.
What are the key properties of N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine has a molecular weight of 231.30 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine is sourced from PubChem (CID 106895060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).