N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine

C14H24N4 — CID 55054912

IUPACN-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine
SMILESCCCN(c1ccc(CNC(C)C)nn1)C1CC1
InChIInChI=1S/C14H24N4/c1-4-9-18(13-6-7-13)14-8-5-12(16-17-14)10-15-11(2)3/h5,8,11,13,15H,4,6-7,9-10H2,1-3H3
InChIKeyZQKJWTUBGLBJJY-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.35
Rot. Bonds7

About N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine

N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine (PubChem CID 55054912) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine
PubChem CID55054912
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine
SMILESCCCN(c1ccc(CNC(C)C)nn1)C1CC1
InChIInChI=1S/C14H24N4/c1-4-9-18(13-6-7-13)14-8-5-12(16-17-14)10-15-11(2)3/h5,8,11,13,15H,4,6-7,9-10H2,1-3H3
InChIKeyZQKJWTUBGLBJJY-UHFFFAOYSA-N
XLogP2.35
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine?
The IUPAC name of N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine (CID 55054912) is N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine.
What is the SMILES notation for N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine?
The canonical SMILES for N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine is CCCN(c1ccc(CNC(C)C)nn1)C1CC1.
What is the InChIKey of N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine?
The InChIKey is ZQKJWTUBGLBJJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-4-9-18(13-6-7-13)14-8-5-12(16-17-14)10-15-11(2)3/h5,8,11,13,15H,4,6-7,9-10H2,1-3H3.
What are the key properties of N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine?
N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine has a molecular weight of 248.37 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-[(propan-2-ylamino)methyl]-N-propylpyridazin-3-amine is sourced from PubChem (CID 55054912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).