N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide

C19H24N4O2 — CID 126436027

IUPACN-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide
SMILESO=C(NCc1ccon1)N1CCN([C@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C19H24N4O2/c24-19(20-14-17-7-12-25-21-17)23-10-8-22(9-11-23)18-6-5-15-3-1-2-4-16(15)13-18/h1-4,7,12,18H,5-6,8-11,13-14H2,(H,20,24)/t18-/m0/s1
InChIKeyYKWJSLWCPKDLCY-SFHVURJKSA-N
MW340.43 g/mol
LogP2.06
Rot. Bonds3

About N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide

N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide (PubChem CID 126436027) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide
PubChem CID126436027
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC NameN-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide
SMILESO=C(NCc1ccon1)N1CCN([C@H]2CCc3ccccc3C2)CC1
InChIInChI=1S/C19H24N4O2/c24-19(20-14-17-7-12-25-21-17)23-10-8-22(9-11-23)18-6-5-15-3-1-2-4-16(15)13-18/h1-4,7,12,18H,5-6,8-11,13-14H2,(H,20,24)/t18-/m0/s1
InChIKeyYKWJSLWCPKDLCY-SFHVURJKSA-N
XLogP2.06
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide with MolForge

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Related Compounds

4-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]-N-(thiophen-2-ylmethyl)piperazine-1-carboxamide
CID 126446363
2-[[4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carbonyl]amino]acetic acid
CID 126434125
N-(1,2-oxazol-3-ylmethyl)azetidine-1-carboxamide
CID 131176570
3-[1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidin-4-yl]propanoic acid
CID 81177584
N-[2-(cyclopropylmethyl)pyrazol-3-yl]-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide
CID 97283042
(2-ethyl-4-pyridinyl)-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]methanone
CID 56913190
N-(6-fluoro-3-pyridinyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide
CID 125161166
2-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]acetic acid
CID 56701450
4-(2,3-dihydro-1H-inden-2-yl)-N-[(4-methylsulfanylphenyl)methyl]piperazine-1-carboxamide
CID 119070259
[4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 95718041
[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]-(1,3-thiazol-4-yl)methanone
CID 56904168
1-(1,2-oxazol-3-ylmethylcarbamoyl)piperidine-2-carboxylic acid
CID 81178491

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide?
The IUPAC name of N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide (CID 126436027) is N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide.
What is the SMILES notation for N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide?
The canonical SMILES for N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide is O=C(NCc1ccon1)N1CCN([C@H]2CCc3ccccc3C2)CC1.
What is the InChIKey of N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide?
The InChIKey is YKWJSLWCPKDLCY-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N4O2/c24-19(20-14-17-7-12-25-21-17)23-10-8-22(9-11-23)18-6-5-15-3-1-2-4-16(15)13-18/h1-4,7,12,18H,5-6,8-11,13-14H2,(H,20,24)/t18-/m0/s1.
What are the key properties of N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide?
N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide has a molecular weight of 340.43 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-3-ylmethyl)-4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carboxamide is sourced from PubChem (CID 126436027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).