1-(cyclopropylmethylsulfonyl)piperidin-2-amine

C9H18N2O2S — CID 64987724

IUPAC1-(cyclopropylmethylsulfonyl)piperidin-2-amine
SMILESNC1CCCCN1S(=O)(=O)CC1CC1
InChIInChI=1S/C9H18N2O2S/c10-9-3-1-2-6-11(9)14(12,13)7-8-4-5-8/h8-9H,1-7,10H2
InChIKeyBRAJCRAQSVKEPJ-UHFFFAOYSA-N
MW218.32 g/mol
LogP0.50
Rot. Bonds3

About 1-(cyclopropylmethylsulfonyl)piperidin-2-amine

1-(cyclopropylmethylsulfonyl)piperidin-2-amine (PubChem CID 64987724) has the molecular formula C9H18N2O2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 1-(cyclopropylmethylsulfonyl)piperidin-2-amine.

Molecular Properties

Compound Name1-(cyclopropylmethylsulfonyl)piperidin-2-amine
PubChem CID64987724
Molecular FormulaC9H18N2O2S
Molecular Weight218.32 g/mol
Exact Mass218.11
IUPAC Name1-(cyclopropylmethylsulfonyl)piperidin-2-amine
SMILESNC1CCCCN1S(=O)(=O)CC1CC1
InChIInChI=1S/C9H18N2O2S/c10-9-3-1-2-6-11(9)14(12,13)7-8-4-5-8/h8-9H,1-7,10H2
InChIKeyBRAJCRAQSVKEPJ-UHFFFAOYSA-N
XLogP0.50
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(cyclopropylmethylsulfonyl)piperidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(oxolan-2-ylmethylsulfonyl)azepan-2-amine
CID 64560160
2-(bromomethyl)-1-(cyclopropylmethylsulfonyl)azepane
CID 116639693
2-[1-(cyclopropylmethylsulfonyl)piperidin-2-yl]ethanol
CID 64988050
1-(cyclopropylmethylsulfonyl)pyrrolidine-2-carboxamide
CID 166222586
1-(3-methylbutylsulfonyl)azepan-2-amine
CID 64560531
1-methylsulfonylazepan-2-amine
CID 64560545
2-amino-N,N-diethylazepane-1-sulfonamide
CID 64560720
2-[1-(cyclopropylmethylsulfonyl)piperidin-2-yl]cyclopentan-1-one
CID 79545751
1-benzylsulfonylazepan-2-amine
CID 64560148
1-pyrrolidin-1-ylsulfonylpyrrolidin-2-amine
CID 43210458
(3R)-1-(cyclopropylmethylsulfonyl)piperidin-3-amine
CID 102977569
4-chloro-1-(cyclohexylmethylsulfonyl)piperidine
CID 63396715

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethylsulfonyl)piperidin-2-amine?
The IUPAC name of 1-(cyclopropylmethylsulfonyl)piperidin-2-amine (CID 64987724) is 1-(cyclopropylmethylsulfonyl)piperidin-2-amine.
What is the SMILES notation for 1-(cyclopropylmethylsulfonyl)piperidin-2-amine?
The canonical SMILES for 1-(cyclopropylmethylsulfonyl)piperidin-2-amine is NC1CCCCN1S(=O)(=O)CC1CC1.
What is the InChIKey of 1-(cyclopropylmethylsulfonyl)piperidin-2-amine?
The InChIKey is BRAJCRAQSVKEPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2S/c10-9-3-1-2-6-11(9)14(12,13)7-8-4-5-8/h8-9H,1-7,10H2.
What are the key properties of 1-(cyclopropylmethylsulfonyl)piperidin-2-amine?
1-(cyclopropylmethylsulfonyl)piperidin-2-amine has a molecular weight of 218.32 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethylsulfonyl)piperidin-2-amine is sourced from PubChem (CID 64987724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).