5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide

C17H26N4O — CID 130365382

IUPAC5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
SMILESCC1CN(C(C)C)CC1NC(=O)c1cc(C2CCC2)cnn1
InChIInChI=1S/C17H26N4O/c1-11(2)21-9-12(3)16(10-21)19-17(22)15-7-14(8-18-20-15)13-5-4-6-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3,(H,19,22)
InChIKeyNIOJQAVEOLKKTJ-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.20
Rot. Bonds4

About 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide

5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide (PubChem CID 130365382) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
PubChem CID130365382
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
SMILESCC1CN(C(C)C)CC1NC(=O)c1cc(C2CCC2)cnn1
InChIInChI=1S/C17H26N4O/c1-11(2)21-9-12(3)16(10-21)19-17(22)15-7-14(8-18-20-15)13-5-4-6-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3,(H,19,22)
InChIKeyNIOJQAVEOLKKTJ-UHFFFAOYSA-N
XLogP2.20
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-5-propan-2-ylpyridazine-3-carboxamide
CID 130375933
6-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
CID 130365347
1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide
CID 130365391
2-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,3-oxazole-4-carboxamide
CID 130375891
5-(azetidin-3-yl)-N-[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130386630
5-cyano-N-[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130386740
5-cyclopropyl-N-[(3S,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1H-imidazole-2-carboxamide;molecular hydrogen
CID 145040166
2,2-difluoro-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)-[1,3]dioxolo[4,5-c]pyridine-6-carboxamide
CID 130365414
5-(2,2-difluoroethyl)-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130395401
5-cyclopropyl-N-[(3S,4R)-1-(3,3-difluorobutan-2-yl)-4-methylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 159011022
N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-4-propan-2-yl-1,3-oxazole-2-carboxamide
CID 146364145
N-[1-[(1S)-1-(3-chlorophenyl)propyl]azetidin-3-yl]-5-cyclopropylpyridazine-3-carboxamide;sulfane
CID 161454548

Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide?
The IUPAC name of 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide (CID 130365382) is 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide?
The canonical SMILES for 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide is CC1CN(C(C)C)CC1NC(=O)c1cc(C2CCC2)cnn1.
What is the InChIKey of 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide?
The InChIKey is NIOJQAVEOLKKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-11(2)21-9-12(3)16(10-21)19-17(22)15-7-14(8-18-20-15)13-5-4-6-13/h7-8,11-13,16H,4-6,9-10H2,1-3H3,(H,19,22).
What are the key properties of 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide?
5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 130365382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).