1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine

C15H20N4O3S — CID 154785610

IUPAC1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine
SMILESNS(=O)(=O)NCC1CCCCN1C(=O)c1ccn2ccccc12
InChIInChI=1S/C15H20N4O3S/c16-23(21,22)17-11-12-5-1-4-9-19(12)15(20)13-7-10-18-8-3-2-6-14(13)18/h2-3,6-8,10,12,17H,1,4-5,9,11H2,(H2,16,21,22)
InChIKeyGHNYMGNYBPFXSO-UHFFFAOYSA-N
MW336.42 g/mol
LogP0.73
Rot. Bonds4

About 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine

1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine (PubChem CID 154785610) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine.

Molecular Properties

Compound Name1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine
PubChem CID154785610
Molecular FormulaC15H20N4O3S
Molecular Weight336.42 g/mol
Exact Mass336.13
IUPAC Name1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine
SMILESNS(=O)(=O)NCC1CCCCN1C(=O)c1ccn2ccccc12
InChIInChI=1S/C15H20N4O3S/c16-23(21,22)17-11-12-5-1-4-9-19(12)15(20)13-7-10-18-8-3-2-6-14(13)18/h2-3,6-8,10,12,17H,1,4-5,9,11H2,(H2,16,21,22)
InChIKeyGHNYMGNYBPFXSO-UHFFFAOYSA-N
XLogP0.73
TPSA96.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(1-ethylindole-3-carbonyl)piperidin-2-yl]methyl]methanesulfonamide
CID 47029988
1-[3-(cyanomethyl)benzoyl]-2-[(sulfamoylamino)methyl]piperidine
CID 126816757
1-[2-(2-phenyltriazol-4-yl)acetyl]-2-[(sulfamoylamino)methyl]piperidine
CID 138058282
2-(2-ethylpiperidine-1-carbonyl)benzenesulfonamide
CID 43266727
N-[[1-[4-(aminomethyl)benzoyl]piperidin-2-yl]methyl]methanesulfonamide;hydrochloride
CID 119288822
[2-(hydroxymethyl)azepan-1-yl]-[2-(propan-2-ylamino)phenyl]methanone
CID 116635542
N-[[1-(4-amino-2-chlorobenzoyl)piperidin-2-yl]methyl]methanesulfonamide;hydrochloride
CID 119722447
N-[[1-(3-aminobenzoyl)piperidin-2-yl]methyl]methanesulfonamide
CID 60944716
[2-(aminomethyl)piperidin-1-yl]-(2-methylphenyl)methanone;hydrochloride
CID 119466148
1,1,1-trifluoro-N-[[1-(quinoline-4-carbonyl)piperidin-2-yl]methyl]methanesulfonamide
CID 175075164
(2-ethylsulfonylphenyl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 43421223
N-[[(2R)-1-(2-methyl-5-propan-2-ylfuran-3-carbonyl)piperidin-2-yl]methyl]methanesulfonamide
CID 124883784

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine?
The IUPAC name of 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine (CID 154785610) is 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine.
What is the SMILES notation for 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine?
The canonical SMILES for 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine is NS(=O)(=O)NCC1CCCCN1C(=O)c1ccn2ccccc12.
What is the InChIKey of 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine?
The InChIKey is GHNYMGNYBPFXSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3S/c16-23(21,22)17-11-12-5-1-4-9-19(12)15(20)13-7-10-18-8-3-2-6-14(13)18/h2-3,6-8,10,12,17H,1,4-5,9,11H2,(H2,16,21,22).
What are the key properties of 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine?
1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine has a molecular weight of 336.42 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(sulfamoylamino)methyl]piperidine-1-carbonyl]indolizine is sourced from PubChem (CID 154785610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).