N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide

C12H25N3O2S — CID 28940516

IUPACN-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide
SMILESCC1CCN(S(=O)(=O)NC2(CN)CCCC2)CC1
InChIInChI=1S/C12H25N3O2S/c1-11-4-8-15(9-5-11)18(16,17)14-12(10-13)6-2-3-7-12/h11,14H,2-10,13H2,1H3
InChIKeyHCJWFVQOUQFYJJ-UHFFFAOYSA-N
MW275.42 g/mol
LogP0.82
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide

N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide (PubChem CID 28940516) has the molecular formula C12H25N3O2S and a molecular weight of 275.42 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide
PubChem CID28940516
Molecular FormulaC12H25N3O2S
Molecular Weight275.42 g/mol
Exact Mass275.17
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide
SMILESCC1CCN(S(=O)(=O)NC2(CN)CCCC2)CC1
InChIInChI=1S/C12H25N3O2S/c1-11-4-8-15(9-5-11)18(16,17)14-12(10-13)6-2-3-7-12/h11,14H,2-10,13H2,1H3
InChIKeyHCJWFVQOUQFYJJ-UHFFFAOYSA-N
XLogP0.82
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.42
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-4-methylpiperidine-1-sulfonamide
CID 43053240
4-methyl-N-(3-methylbutan-2-yl)piperidine-1-sulfonamide
CID 43053258
1-(2-Cyclopentylethyl)-3-[(sulfamoylamino)methyl]piperidine
CID 72000005
N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
N-ethyl-4-methylpiperidine-1-sulfonamide
CID 43243291
N-ethyl-4-propan-2-ylpiperidine-1-sulfonamide
CID 59291801
4-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 60728161
(5R,7S)-7-methyl-1-pentyl-2lambda6-thia-1,3,8-triazaspiro[4.5]decane 2,2-dioxide
CID 66931365
7-Methyl-1-pentyl-2lambda6-thia-1,3,8-triazaspiro[4.5]decane 2,2-dioxide
CID 66931367
4-(3-Aminopropyl)piperidine-1-sulfonamide
CID 69121315
N-[1-[(4-methylpiperidin-1-yl)methyl]cyclopentyl]methanesulfonamide
CID 130216764
N-(2-methylpentan-2-yl)piperidine-1-sulfonamide
CID 130342800

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide (CID 28940516) is N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide is CC1CCN(S(=O)(=O)NC2(CN)CCCC2)CC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide?
The InChIKey is HCJWFVQOUQFYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2S/c1-11-4-8-15(9-5-11)18(16,17)14-12(10-13)6-2-3-7-12/h11,14H,2-10,13H2,1H3.
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide?
N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide has a molecular weight of 275.42 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-4-methylpiperidine-1-sulfonamide is sourced from PubChem (CID 28940516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).