N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine

C19H26N4 — CID 74248315

IUPACN-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine
SMILESCC(c1ccc(-c2ccc(NC3CCCC3)nn2)cc1)N(C)C
InChIInChI=1S/C19H26N4/c1-14(23(2)3)15-8-10-16(11-9-15)18-12-13-19(22-21-18)20-17-6-4-5-7-17/h8-14,17H,4-7H2,1-3H3,(H,20,22)
InChIKeyVLTVFCSPBJMICS-UHFFFAOYSA-N
MW310.45 g/mol
LogP4.12
Rot. Bonds5

About N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine

N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine (PubChem CID 74248315) has the molecular formula C19H26N4 and a molecular weight of 310.45 g/mol. Its IUPAC name is N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine
PubChem CID74248315
Molecular FormulaC19H26N4
Molecular Weight310.45 g/mol
Exact Mass310.22
IUPAC NameN-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine
SMILESCC(c1ccc(-c2ccc(NC3CCCC3)nn2)cc1)N(C)C
InChIInChI=1S/C19H26N4/c1-14(23(2)3)15-8-10-16(11-9-15)18-12-13-19(22-21-18)20-17-6-4-5-7-17/h8-14,17H,4-7H2,1-3H3,(H,20,22)
InChIKeyVLTVFCSPBJMICS-UHFFFAOYSA-N
XLogP4.12
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.45
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine?
The IUPAC name of N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine (CID 74248315) is N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine.
What is the SMILES notation for N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine?
The canonical SMILES for N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine is CC(c1ccc(-c2ccc(NC3CCCC3)nn2)cc1)N(C)C.
What is the InChIKey of N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine?
The InChIKey is VLTVFCSPBJMICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4/c1-14(23(2)3)15-8-10-16(11-9-15)18-12-13-19(22-21-18)20-17-6-4-5-7-17/h8-14,17H,4-7H2,1-3H3,(H,20,22).
What are the key properties of N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine?
N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine has a molecular weight of 310.45 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[4-[1-(dimethylamino)ethyl]phenyl]pyridazin-3-amine is sourced from PubChem (CID 74248315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).