N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine

C15H21N5 — CID 103294542

IUPACN-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCc1cnn(-c2cccnn2)c1C1CC1
InChIInChI=1S/C15H21N5/c1-11(2)8-16-9-13-10-18-20(15(13)12-5-6-12)14-4-3-7-17-19-14/h3-4,7,10-12,16H,5-6,8-9H2,1-2H3
InChIKeyHIZKUCKGHFATHU-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.29
Rot. Bonds6

About N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine

N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine (PubChem CID 103294542) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine
PubChem CID103294542
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC NameN-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine
SMILESCC(C)CNCc1cnn(-c2cccnn2)c1C1CC1
InChIInChI=1S/C15H21N5/c1-11(2)8-16-9-13-10-18-20(15(13)12-5-6-12)14-4-3-7-17-19-14/h3-4,7,10-12,16H,5-6,8-9H2,1-2H3
InChIKeyHIZKUCKGHFATHU-UHFFFAOYSA-N
XLogP2.29
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-cyclopropyl-1-(2-ethylsulfonylethyl)pyrazol-4-yl]methyl]-2-methylpropan-1-amine
CID 66442018
2-methyl-N-[(5-propan-2-yl-1-pyridazin-3-ylpyrazol-4-yl)methyl]propan-2-amine
CID 103294541
N-[[5-(difluoromethyl)-1-pyridazin-3-ylpyrazol-4-yl]methyl]-2-methoxyethanamine
CID 103294536
(5-ethyl-1-pyridazin-3-ylpyrazol-4-yl)methanamine
CID 103294537
N-[(2-indazol-1-yl-3-pyridinyl)methyl]-2-methylpropan-1-amine
CID 62294643
N-[(5-cyclopropyl-1,2-oxazol-4-yl)methyl]-2-methylpropan-1-amine
CID 65239951
N-methyl-N-[[3-[(2-methylpropylamino)methyl]-2-pyridinyl]methyl]cyclopropanamine
CID 114198984
N-[[5-cyclopropyl-1-(2,5-dimethylphenyl)pyrazol-4-yl]methyl]propan-1-amine
CID 66442303
N-[[1-(3-chloro-4-methylphenyl)-5-cyclopropylpyrazol-4-yl]methyl]ethanamine
CID 66440038
N-[[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 115562080
1-cyclopropyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82527082
1-[3-[(2-methylpropylamino)methyl]-2-pyridinyl]piperidine-4-carboxamide
CID 103880534

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine (CID 103294542) is N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine is CC(C)CNCc1cnn(-c2cccnn2)c1C1CC1.
What is the InChIKey of N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine?
The InChIKey is HIZKUCKGHFATHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-11(2)8-16-9-13-10-18-20(15(13)12-5-6-12)14-4-3-7-17-19-14/h3-4,7,10-12,16H,5-6,8-9H2,1-2H3.
What are the key properties of N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine?
N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine has a molecular weight of 271.37 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopropyl-1-pyridazin-3-ylpyrazol-4-yl)methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 103294542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).