2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine

C15H30N2O2S — CID 106624303

IUPAC2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
SMILESCC(C)N(CC1CCCNC1)C1CCCC1S(C)(=O)=O
InChIInChI=1S/C15H30N2O2S/c1-12(2)17(11-13-6-5-9-16-10-13)14-7-4-8-15(14)20(3,18)19/h12-16H,4-11H2,1-3H3
InChIKeyYIYUJNXVLMCJJZ-UHFFFAOYSA-N
MW302.48 g/mol
LogP1.66
Rot. Bonds5

About 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine

2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine (PubChem CID 106624303) has the molecular formula C15H30N2O2S and a molecular weight of 302.48 g/mol. Its IUPAC name is 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine.

Molecular Properties

Compound Name2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
PubChem CID106624303
Molecular FormulaC15H30N2O2S
Molecular Weight302.48 g/mol
Exact Mass302.20
IUPAC Name2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
SMILESCC(C)N(CC1CCCNC1)C1CCCC1S(C)(=O)=O
InChIInChI=1S/C15H30N2O2S/c1-12(2)17(11-13-6-5-9-16-10-13)14-7-4-8-15(14)20(3,18)19/h12-16H,4-11H2,1-3H3
InChIKeyYIYUJNXVLMCJJZ-UHFFFAOYSA-N
XLogP1.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.48
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-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

N-ethyl-2-methylsulfonyl-N-(piperidin-3-ylmethyl)cyclopentan-1-amine
CID 106624711
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106624180
2,4,4-trimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106663562
4,4-dimethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohexan-1-amine
CID 106624301
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohex-2-en-1-amine
CID 106637323
N-(piperidin-3-ylmethyl)-N-propan-2-ylpropane-2-sulfonamide
CID 106630952
3-ethyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine
CID 106624200
N-cyclopropyl-N-(piperidin-3-ylmethyl)methanesulfonamide
CID 106631170
N-methyl-N-(2-methylsulfonylcyclohexyl)-3-piperidin-3-ylbutanamide
CID 119803178
1-cyclohexyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 106630965
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclobutanecarboxamide
CID 106629002

Frequently Asked Questions

What is the IUPAC name of 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine?
The IUPAC name of 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine (CID 106624303) is 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine.
What is the SMILES notation for 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine?
The canonical SMILES for 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine is CC(C)N(CC1CCCNC1)C1CCCC1S(C)(=O)=O.
What is the InChIKey of 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine?
The InChIKey is YIYUJNXVLMCJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2S/c1-12(2)17(11-13-6-5-9-16-10-13)14-7-4-8-15(14)20(3,18)19/h12-16H,4-11H2,1-3H3.
What are the key properties of 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine?
2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine has a molecular weight of 302.48 g/mol, XLogP of 1.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfonyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclopentan-1-amine is sourced from PubChem (CID 106624303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).