N-[2-(aminomethyl)cyclopentyl]methanesulfinamide

C7H16N2OS — CID 131184978

IUPACN-[2-(aminomethyl)cyclopentyl]methanesulfinamide
SMILESCS(=O)NC1CCCC1CN
InChIInChI=1S/C7H16N2OS/c1-11(10)9-7-4-2-3-6(7)5-8/h6-7,9H,2-5,8H2,1H3
InChIKeyCHRKJVCRSAMJEJ-UHFFFAOYSA-N
MW176.28 g/mol
LogP-0.00
Rot. Bonds3

About N-[2-(aminomethyl)cyclopentyl]methanesulfinamide

N-[2-(aminomethyl)cyclopentyl]methanesulfinamide (PubChem CID 131184978) has the molecular formula C7H16N2OS and a molecular weight of 176.28 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]methanesulfinamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]methanesulfinamide
PubChem CID131184978
Molecular FormulaC7H16N2OS
Molecular Weight176.28 g/mol
Exact Mass176.10
IUPAC NameN-[2-(aminomethyl)cyclopentyl]methanesulfinamide
SMILESCS(=O)NC1CCCC1CN
InChIInChI=1S/C7H16N2OS/c1-11(10)9-7-4-2-3-6(7)5-8/h6-7,9H,2-5,8H2,1H3
InChIKeyCHRKJVCRSAMJEJ-UHFFFAOYSA-N
XLogP-0.00
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.28
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]methanesulfinamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]methanesulfinamide (CID 131184978) is N-[2-(aminomethyl)cyclopentyl]methanesulfinamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]methanesulfinamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]methanesulfinamide is CS(=O)NC1CCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]methanesulfinamide?
The InChIKey is CHRKJVCRSAMJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2OS/c1-11(10)9-7-4-2-3-6(7)5-8/h6-7,9H,2-5,8H2,1H3.
What are the key properties of N-[2-(aminomethyl)cyclopentyl]methanesulfinamide?
N-[2-(aminomethyl)cyclopentyl]methanesulfinamide has a molecular weight of 176.28 g/mol, XLogP of -0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]methanesulfinamide is sourced from PubChem (CID 131184978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).