1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone

C10H17N5O — CID 110498361

IUPAC1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone
SMILESCC1CCCN(C(=O)Cc2nnnn2C)C1
InChIInChI=1S/C10H17N5O/c1-8-4-3-5-15(7-8)10(16)6-9-11-12-13-14(9)2/h8H,3-7H2,1-2H3
InChIKeyMMVKLMMXBBLSNV-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.01
Rot. Bonds2

About 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone

1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone (PubChem CID 110498361) has the molecular formula C10H17N5O and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone.

Molecular Properties

Compound Name1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone
PubChem CID110498361
Molecular FormulaC10H17N5O
Molecular Weight223.28 g/mol
Exact Mass223.14
IUPAC Name1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone
SMILESCC1CCCN(C(=O)Cc2nnnn2C)C1
InChIInChI=1S/C10H17N5O/c1-8-4-3-5-15(7-8)10(16)6-9-11-12-13-14(9)2/h8H,3-7H2,1-2H3
InChIKeyMMVKLMMXBBLSNV-UHFFFAOYSA-N
XLogP0.01
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(azepan-1-yl)-2-(1-methyltetrazol-5-yl)ethanone
CID 110498346
1-(3-methylpiperidin-1-yl)-2-methylsulfanylethanone
CID 42910082
1-[(3S)-3-methylpiperidin-1-yl]-2-phenylethanone
CID 668860
2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-[(3R)-3-methylpiperidin-1-yl]ethanone
CID 9273096
1-(3-methylpiperidin-1-yl)-2-(1H-pyrrol-3-yl)ethanone
CID 110769174
2-(4-fluorophenyl)-1-(3-methylpiperidin-1-yl)ethanone
CID 2915380
2-(4-bromophenyl)-1-[(3R)-3-methylpiperidin-1-yl]ethanone
CID 875891
2-(1H-imidazol-5-yl)-1-(3-methylpiperidin-1-yl)ethanone
CID 110684132
1-(3-methylpiperidin-1-yl)-2-pyridin-2-ylethanone
CID 110696959
2-(2-amino-5-methylphenyl)-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 99991754
2-(dimethylamino)-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 131045839
4-[(3R)-3-methylpiperidin-1-yl]-4-oxobutanoic acid
CID 40543101

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone?
The IUPAC name of 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone (CID 110498361) is 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone.
What is the SMILES notation for 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone?
The canonical SMILES for 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone is CC1CCCN(C(=O)Cc2nnnn2C)C1.
What is the InChIKey of 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone?
The InChIKey is MMVKLMMXBBLSNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O/c1-8-4-3-5-15(7-8)10(16)6-9-11-12-13-14(9)2/h8H,3-7H2,1-2H3.
What are the key properties of 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone?
1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone has a molecular weight of 223.28 g/mol, XLogP of 0.01, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylpiperidin-1-yl)-2-(1-methyltetrazol-5-yl)ethanone is sourced from PubChem (CID 110498361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).