N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide

C16H22N4O2 — CID 126917260

IUPACN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide
SMILESCN(C(=O)C1CCCO1)C1CN(c2ccc(C3CC3)nn2)C1
InChIInChI=1S/C16H22N4O2/c1-19(16(21)14-3-2-8-22-14)12-9-20(10-12)15-7-6-13(17-18-15)11-4-5-11/h6-7,11-12,14H,2-5,8-10H2,1H3
InChIKeyWBCKYGNTWSWVJF-UHFFFAOYSA-N
MW302.38 g/mol
LogP1.18
Rot. Bonds4

About N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide

N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide (PubChem CID 126917260) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide
PubChem CID126917260
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide
SMILESCN(C(=O)C1CCCO1)C1CN(c2ccc(C3CC3)nn2)C1
InChIInChI=1S/C16H22N4O2/c1-19(16(21)14-3-2-8-22-14)12-9-20(10-12)15-7-6-13(17-18-15)11-4-5-11/h6-7,11-12,14H,2-5,8-10H2,1H3
InChIKeyWBCKYGNTWSWVJF-UHFFFAOYSA-N
XLogP1.18
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 122279219
3-cyclopentyl-1-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-1-methylurea
CID 126917267
N-[1-(3-tert-butyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)azetidin-3-yl]-N-methyloxane-2-carboxamide
CID 134160816
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyl-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 126917233
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide
CID 126917333
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylquinoxaline-2-carboxamide
CID 126917242
N-cyclobutyl-N-methyloxolane-2-carboxamide
CID 127002329
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,5,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 126917285
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-(2-morpholin-4-ylethyl)azetidin-3-amine
CID 126917365
3-[[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-methylamino]methyl]-1-methylsulfonylpiperidin-3-ol
CID 126917626
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]azetidin-3-amine
CID 126917480
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]azetidin-3-amine
CID 126917500

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide?
The IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide (CID 126917260) is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide.
What is the SMILES notation for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide?
The canonical SMILES for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide is CN(C(=O)C1CCCO1)C1CN(c2ccc(C3CC3)nn2)C1.
What is the InChIKey of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide?
The InChIKey is WBCKYGNTWSWVJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c1-19(16(21)14-3-2-8-22-14)12-9-20(10-12)15-7-6-13(17-18-15)11-4-5-11/h6-7,11-12,14H,2-5,8-10H2,1H3.
What are the key properties of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide?
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide has a molecular weight of 302.38 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide is sourced from PubChem (CID 126917260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).