N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide

C16H20N6O2 — CID 131890339

IUPACN-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide
SMILESCc1nnnn1-c1cccc(NC(=O)CCN2CCCCC2=O)c1
InChIInChI=1S/C16H20N6O2/c1-12-18-19-20-22(12)14-6-4-5-13(11-14)17-15(23)8-10-21-9-3-2-7-16(21)24/h4-6,11H,2-3,7-10H2,1H3,(H,17,23)
InChIKeyHTFFZOGPFVCGAW-UHFFFAOYSA-N
MW328.38 g/mol
LogP1.31
Rot. Bonds5

About N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide

N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide (PubChem CID 131890339) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide
PubChem CID131890339
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC NameN-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide
SMILESCc1nnnn1-c1cccc(NC(=O)CCN2CCCCC2=O)c1
InChIInChI=1S/C16H20N6O2/c1-12-18-19-20-22(12)14-6-4-5-13(11-14)17-15(23)8-10-21-9-3-2-7-16(21)24/h4-6,11H,2-3,7-10H2,1H3,(H,17,23)
InChIKeyHTFFZOGPFVCGAW-UHFFFAOYSA-N
XLogP1.31
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide
CID 43701560
3-(cyclopropylamino)-N-[3-(5-methyltetrazol-1-yl)phenyl]propanamide
CID 60866406
4-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]pentanamide;hydrochloride
CID 120560652
7-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]heptanamide;hydrochloride
CID 119733067
N-[3-(5-methyltetrazol-1-yl)phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
CID 131901993
2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-[3-(5-methyltetrazol-1-yl)phenyl]acetamide
CID 55676941
1-[3-(5-methyltetrazol-1-yl)phenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 72875346
2-[2-[3-(5-methyltetrazol-1-yl)anilino]-2-oxoethoxy]acetic acid
CID 61329417
4-(3-methylphenoxy)-N-[3-(5-methyltetrazol-1-yl)phenyl]butanamide
CID 55677152
4-amino-3-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]butanamide
CID 81075886
N-[3-(5-methyltetrazol-1-yl)phenyl]-3-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanamide
CID 55681274
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
CID 18717027

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide?
The IUPAC name of N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide (CID 131890339) is N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide.
What is the SMILES notation for N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide?
The canonical SMILES for N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide is Cc1nnnn1-c1cccc(NC(=O)CCN2CCCCC2=O)c1.
What is the InChIKey of N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide?
The InChIKey is HTFFZOGPFVCGAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c1-12-18-19-20-22(12)14-6-4-5-13(11-14)17-15(23)8-10-21-9-3-2-7-16(21)24/h4-6,11H,2-3,7-10H2,1H3,(H,17,23).
What are the key properties of N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide?
N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide has a molecular weight of 328.38 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-methyltetrazol-1-yl)phenyl]-3-(2-oxopiperidin-1-yl)propanamide is sourced from PubChem (CID 131890339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).