N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide

C16H21N3O2 — CID 102567259

IUPACN-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide
SMILESCC(Oc1nn(C)c2ccccc12)C(=O)NCCC1CC1
InChIInChI=1S/C16H21N3O2/c1-11(15(20)17-10-9-12-7-8-12)21-16-13-5-3-4-6-14(13)19(2)18-16/h3-6,11-12H,7-10H2,1-2H3,(H,17,20)
InChIKeyMZMWRSSMULHWFD-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.26
Rot. Bonds6

About N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide

N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide (PubChem CID 102567259) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide.

Molecular Properties

Compound NameN-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide
PubChem CID102567259
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide
SMILESCC(Oc1nn(C)c2ccccc12)C(=O)NCCC1CC1
InChIInChI=1S/C16H21N3O2/c1-11(15(20)17-10-9-12-7-8-12)21-16-13-5-3-4-6-14(13)19(2)18-16/h3-6,11-12H,7-10H2,1-2H3,(H,17,20)
InChIKeyMZMWRSSMULHWFD-UHFFFAOYSA-N
XLogP2.26
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylindazol-3-yl)oxypropanoic acid
CID 112757766
(2S)-2-(1-methylindazol-3-yl)oxypropanoic acid
CID 124676429
(2R)-2-(1-methylindazol-3-yl)oxy-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one
CID 100816548
(2R)-1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-(1-methylindazol-3-yl)oxypropan-1-one
CID 100816542
(2R)-2-(2-chlorophenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702543
(2R)-N-[2-(1-methylpiperidin-4-yl)ethyl]-2-naphthalen-2-yloxypropanamide
CID 99972258
3-cyclopropyl-1-(1-methylindazol-3-yl)propan-1-one
CID 103124770
(2R)-2-(5-bromo-1-methylindazol-3-yl)oxy-N-[[(2R)-oxolan-2-yl]methyl]propanamide
CID 100816507
N-[(4-chlorocyclohexyl)methyl]-1-methylindazole-3-carboxamide
CID 106133570
(2R)-2-(4-tert-butylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702455
(2S)-2-(4-tert-butylphenoxy)-N-[2-(1-methylpiperidin-4-yl)ethyl]propanamide
CID 99702454
3-(cyclopropylmethyl)-1-methylindazole
CID 142276732

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide?
The IUPAC name of N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide (CID 102567259) is N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide.
What is the SMILES notation for N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide?
The canonical SMILES for N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide is CC(Oc1nn(C)c2ccccc12)C(=O)NCCC1CC1.
What is the InChIKey of N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide?
The InChIKey is MZMWRSSMULHWFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11(15(20)17-10-9-12-7-8-12)21-16-13-5-3-4-6-14(13)19(2)18-16/h3-6,11-12H,7-10H2,1-2H3,(H,17,20).
What are the key properties of N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide?
N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide has a molecular weight of 287.36 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylethyl)-2-(1-methylindazol-3-yl)oxypropanamide is sourced from PubChem (CID 102567259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).