(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine

C10H15N3O2S — CID 114613060

IUPAC(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
SMILESNCc1ccc(S(=O)(=O)N2CCCC2)cn1
InChIInChI=1S/C10H15N3O2S/c11-7-9-3-4-10(8-12-9)16(14,15)13-5-1-2-6-13/h3-4,8H,1-2,5-7,11H2
InChIKeyQUSAUSLEGVRCBR-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.32
Rot. Bonds3

About (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine

(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine (PubChem CID 114613060) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
PubChem CID114613060
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine
SMILESNCc1ccc(S(=O)(=O)N2CCCC2)cn1
InChIInChI=1S/C10H15N3O2S/c11-7-9-3-4-10(8-12-9)16(14,15)13-5-1-2-6-13/h3-4,8H,1-2,5-7,11H2
InChIKeyQUSAUSLEGVRCBR-UHFFFAOYSA-N
XLogP0.32
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-ethylpiperazin-1-yl)sulfonyl-2-pyridinyl]methanamine
CID 114613052
[5-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-ylsulfonyl)-2-pyridinyl]methanamine
CID 114613483
1-[[6-(aminomethyl)-3-pyridinyl]sulfonyl]-3-methylpyrrolidin-3-ol
CID 103355759
1-[[6-(aminomethyl)-3-pyridinyl]sulfonyl]-3-methylpiperidin-4-ol
CID 114678175
5-(azocan-1-ylsulfonyl)pyridine-2-carbothioamide
CID 114614086
5-(azepan-1-ylsulfonyl)pyridine-2-carbothioamide
CID 114613969
[5-(4-ethyl-3-methylpiperazin-1-yl)sulfonyl-2-pyridinyl]methanamine
CID 114613509
2-ethoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268013
2-methoxy-5-piperidin-1-ylsulfonylpyridine
CID 5268012
2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
CID 8567255
5-pyrrolidin-1-ylsulfonyl-2-(2,2,2-trifluoroethoxy)pyridine
CID 75448158
N-propan-2-yl-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268153

Frequently Asked Questions

What is the IUPAC name of (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine?
The IUPAC name of (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine (CID 114613060) is (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine.
What is the SMILES notation for (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine?
The canonical SMILES for (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine is NCc1ccc(S(=O)(=O)N2CCCC2)cn1.
What is the InChIKey of (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine?
The InChIKey is QUSAUSLEGVRCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-7-9-3-4-10(8-12-9)16(14,15)13-5-1-2-6-13/h3-4,8H,1-2,5-7,11H2.
What are the key properties of (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine?
(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine has a molecular weight of 241.32 g/mol, XLogP of 0.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)methanamine is sourced from PubChem (CID 114613060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).