N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine

C12H15N3O — CID 62482242

IUPACN-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine
SMILESCC(CCc1ccco1)Nc1cccnn1
InChIInChI=1S/C12H15N3O/c1-10(6-7-11-4-3-9-16-11)14-12-5-2-8-13-15-12/h2-5,8-10H,6-7H2,1H3,(H,14,15)
InChIKeyCKVFJBPFWROIRQ-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.50
Rot. Bonds5

About N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine

N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine (PubChem CID 62482242) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine
PubChem CID62482242
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine
SMILESCC(CCc1ccco1)Nc1cccnn1
InChIInChI=1S/C12H15N3O/c1-10(6-7-11-4-3-9-16-11)14-12-5-2-8-13-15-12/h2-5,8-10H,6-7H2,1H3,(H,14,15)
InChIKeyCKVFJBPFWROIRQ-UHFFFAOYSA-N
XLogP2.50
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(furan-2-yl)butan-2-yl]quinoxalin-2-amine
CID 60716487
2-N-[4-(furan-2-yl)butan-2-yl]-4-methylpyridine-2,5-diamine
CID 79173050
2-[4-(furan-2-yl)butan-2-ylamino]pyridine-3-carboxamide
CID 60726854
6-chloro-2-N-[4-(furan-2-yl)butan-2-yl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80804357
N-[4-(furan-2-yl)butan-2-yl]-4,5-dihydro-1H-imidazol-2-amine
CID 115601215
N-[4-(furan-2-yl)butan-2-yl]-6-pyrazol-1-ylpyrazin-2-amine
CID 71940133
N-(1-ethoxypropan-2-yl)pyridazin-3-amine
CID 62483257
6-[4-(furan-2-yl)butan-2-ylamino]pyrazine-2-carboxylic acid
CID 66449084
4-bromo-2,3-dichloro-N-[4-(furan-2-yl)butan-2-yl]aniline
CID 107787692
N-[4-(furan-2-yl)butan-2-yl]-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62860172
N-[4-(furan-2-yl)butan-2-yl]acridin-9-amine
CID 4516381
N-[4-(furan-2-yl)butan-2-yl]-5-(methylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106959609

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine (CID 62482242) is N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine is CC(CCc1ccco1)Nc1cccnn1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine?
The InChIKey is CKVFJBPFWROIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-10(6-7-11-4-3-9-16-11)14-12-5-2-8-13-15-12/h2-5,8-10H,6-7H2,1H3,(H,14,15).
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine?
N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine has a molecular weight of 217.27 g/mol, XLogP of 2.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine is sourced from PubChem (CID 62482242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).