2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide

C10H18N2O3S — CID 103308242

IUPAC2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide
SMILESNCC1CCCC1C(=O)NS(=O)(=O)C1CC1
InChIInChI=1S/C10H18N2O3S/c11-6-7-2-1-3-9(7)10(13)12-16(14,15)8-4-5-8/h7-9H,1-6,11H2,(H,12,13)
InChIKeyWRVVJPADVPKRQZ-UHFFFAOYSA-N
MW246.33 g/mol
LogP-0.03
Rot. Bonds4

About 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide

2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide (PubChem CID 103308242) has the molecular formula C10H18N2O3S and a molecular weight of 246.33 g/mol. Its IUPAC name is 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide
PubChem CID103308242
Molecular FormulaC10H18N2O3S
Molecular Weight246.33 g/mol
Exact Mass246.10
IUPAC Name2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide
SMILESNCC1CCCC1C(=O)NS(=O)(=O)C1CC1
InChIInChI=1S/C10H18N2O3S/c11-6-7-2-1-3-9(7)10(13)12-16(14,15)8-4-5-8/h7-9H,1-6,11H2,(H,12,13)
InChIKeyWRVVJPADVPKRQZ-UHFFFAOYSA-N
XLogP-0.03
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide?
The IUPAC name of 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide (CID 103308242) is 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide?
The canonical SMILES for 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide is NCC1CCCC1C(=O)NS(=O)(=O)C1CC1.
What is the InChIKey of 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide?
The InChIKey is WRVVJPADVPKRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3S/c11-6-7-2-1-3-9(7)10(13)12-16(14,15)8-4-5-8/h7-9H,1-6,11H2,(H,12,13).
What are the key properties of 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide?
2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide has a molecular weight of 246.33 g/mol, XLogP of -0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-cyclopropylsulfonylcyclopentane-1-carboxamide is sourced from PubChem (CID 103308242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).