N-(cyclopropylmethyl)pyridazine-3-carboxamide

C9H11N3O — CID 158437543

IUPACN-(cyclopropylmethyl)pyridazine-3-carboxamide
SMILESO=C(NCC1CC1)c1cccnn1
InChIInChI=1S/C9H11N3O/c13-9(10-6-7-3-4-7)8-2-1-5-11-12-8/h1-2,5,7H,3-4,6H2,(H,10,13)
InChIKeyHCKMUVLNLRJHTB-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.62
Rot. Bonds3

About N-(cyclopropylmethyl)pyridazine-3-carboxamide

N-(cyclopropylmethyl)pyridazine-3-carboxamide (PubChem CID 158437543) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is N-(cyclopropylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)pyridazine-3-carboxamide
PubChem CID158437543
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC NameN-(cyclopropylmethyl)pyridazine-3-carboxamide
SMILESO=C(NCC1CC1)c1cccnn1
InChIInChI=1S/C9H11N3O/c13-9(10-6-7-3-4-7)8-2-1-5-11-12-8/h1-2,5,7H,3-4,6H2,(H,10,13)
InChIKeyHCKMUVLNLRJHTB-UHFFFAOYSA-N
XLogP0.62
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclopropylethyl)pyridazine-3-carboxamide;hydrochloride
CID 141153348
N-[(4-methylcyclohexyl)methyl]pyridine-2-carboxamide
CID 142228338
6-N-(cyclohexylmethyl)pyridine-2,6-dicarboxamide
CID 139664789
N-[[1-[(3-methyl-1H-indol-2-yl)methyl]pyrrolidin-3-yl]methyl]pyridazine-3-carboxamide
CID 56709660
N-(4-hydroxycyclohexyl)pyridazine-3-carboxamide
CID 141460592
3-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 104740792
6-chloro-N-[(4-hydroxycyclohexyl)methyl]pyridazine-3-carboxamide
CID 114146608
N-pentylpyridazine-3-carboxamide;hydrochloride
CID 143205726
N-(3-phenylpropyl)pyridazine-3-carboxamide
CID 152622333
N-(cyclopropylmethyl)-3-propan-2-ylpyridine-2-carboxamide
CID 170671139
N-(cyclopentylmethyl)-6-fluoropyridine-2-carboxamide
CID 115496783
5-amino-N-(cyclopropylmethyl)pyridine-2-carboxamide
CID 81319676

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)pyridazine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)pyridazine-3-carboxamide (CID 158437543) is N-(cyclopropylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)pyridazine-3-carboxamide is O=C(NCC1CC1)c1cccnn1.
What is the InChIKey of N-(cyclopropylmethyl)pyridazine-3-carboxamide?
The InChIKey is HCKMUVLNLRJHTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c13-9(10-6-7-3-4-7)8-2-1-5-11-12-8/h1-2,5,7H,3-4,6H2,(H,10,13).
What are the key properties of N-(cyclopropylmethyl)pyridazine-3-carboxamide?
N-(cyclopropylmethyl)pyridazine-3-carboxamide has a molecular weight of 177.21 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 158437543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).