N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide

C17H24N4O2 — CID 122569470

IUPACN-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
SMILESCC(C)c1cc(CNC(=O)CCc2n[nH]c3c2CCCC3)no1
InChIInChI=1S/C17H24N4O2/c1-11(2)16-9-12(21-23-16)10-18-17(22)8-7-15-13-5-3-4-6-14(13)19-20-15/h9,11H,3-8,10H2,1-2H3,(H,18,22)(H,19,20)
InChIKeyIZKHQRNXFUUFFJ-UHFFFAOYSA-N
MW316.41 g/mol
LogP2.65
Rot. Bonds6

About N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide

N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide (PubChem CID 122569470) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide.

Molecular Properties

Compound NameN-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
PubChem CID122569470
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC NameN-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
SMILESCC(C)c1cc(CNC(=O)CCc2n[nH]c3c2CCCC3)no1
InChIInChI=1S/C17H24N4O2/c1-11(2)16-9-12(21-23-16)10-18-17(22)8-7-15-13-5-3-4-6-14(13)19-20-15/h9,11H,3-8,10H2,1-2H3,(H,18,22)(H,19,20)
InChIKeyIZKHQRNXFUUFFJ-UHFFFAOYSA-N
XLogP2.65
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(azocan-1-yl)-N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]propanamide
CID 46991432
N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 72927177
N-[(5-methoxy-1,3-benzoxazol-2-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 91841825
N-[(4-cyclohexyl-1,2,4-triazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 50977335
N-[(3,5-dimethyl-4H-1,2-oxazol-5-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 50976082
3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanoate
CID 7236613
N-(2-phenylsulfanylethyl)-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 74240719
N-[(4-oxo-3H-quinazolin-2-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 136663690
N-[2-(2-fluorophenoxy)ethyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 74249074
N-[2-[(3-methyl-2-pyridinyl)amino]ethyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 131925742
N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide
CID 91831552
5-methyl-N-[2-(4,5,6,7-tetrahydro-1H-indazol-3-yl)ethyl]thiophene-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide?
The IUPAC name of N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide (CID 122569470) is N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide.
What is the SMILES notation for N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide?
The canonical SMILES for N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide is CC(C)c1cc(CNC(=O)CCc2n[nH]c3c2CCCC3)no1.
What is the InChIKey of N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide?
The InChIKey is IZKHQRNXFUUFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-11(2)16-9-12(21-23-16)10-18-17(22)8-7-15-13-5-3-4-6-14(13)19-20-15/h9,11H,3-8,10H2,1-2H3,(H,18,22)(H,19,20).
What are the key properties of N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide?
N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide has a molecular weight of 316.41 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-propan-2-yl-1,2-oxazol-3-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propanamide is sourced from PubChem (CID 122569470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).