N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide

C13H28N2O2S — CID 170963522

IUPACN-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide
SMILESCC(C)CC(CNC1CCCC1)N(C)S(C)(=O)=O
InChIInChI=1S/C13H28N2O2S/c1-11(2)9-13(15(3)18(4,16)17)10-14-12-7-5-6-8-12/h11-14H,5-10H2,1-4H3
InChIKeyPFPAAZHLALKVCO-UHFFFAOYSA-N
MW276.45 g/mol
LogP1.82
Rot. Bonds7

About N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide

N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide (PubChem CID 170963522) has the molecular formula C13H28N2O2S and a molecular weight of 276.45 g/mol. Its IUPAC name is N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide
PubChem CID170963522
Molecular FormulaC13H28N2O2S
Molecular Weight276.45 g/mol
Exact Mass276.19
IUPAC NameN-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide
SMILESCC(C)CC(CNC1CCCC1)N(C)S(C)(=O)=O
InChIInChI=1S/C13H28N2O2S/c1-11(2)9-13(15(3)18(4,16)17)10-14-12-7-5-6-8-12/h11-14H,5-10H2,1-4H3
InChIKeyPFPAAZHLALKVCO-UHFFFAOYSA-N
XLogP1.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide 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

ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
1-N-cyclopentyl-2-N,2-N-dimethylpropane-1,2-diamine
CID 61044044
N-cyclooctyl-1-(cyclopropylamino)propane-2-sulfonamide
CID 106058802
3-[(cycloheptylamino)methyl]-5-methylhexanoic acid
CID 82932880
1-N-cyclohexyl-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 43205547
N-(2-cyclohexyl-4-methylpentyl)cyclopropanamine
CID 82931479
1-N-(3,5-dimethylcyclohexyl)-2-N,2-N,4-trimethylpentane-1,2-diamine
CID 64724441
1-N-[2-(dimethylamino)-4-methylpentyl]cyclobutane-1,3-diamine
CID 80559919
1-N-cyclopentyl-2-N-methyl-2-N-(3-methylbutyl)propane-1,2-diamine
CID 62569636
N-[4-methyl-2-(2-methylpropyl)pentyl]cyclopropanamine
CID 62530308
N-[(2S)-2,3-dimethylbutyl]cyclopentanamine
CID 59085010

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide?
The IUPAC name of N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide (CID 170963522) is N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide is CC(C)CC(CNC1CCCC1)N(C)S(C)(=O)=O.
What is the InChIKey of N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide?
The InChIKey is PFPAAZHLALKVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2S/c1-11(2)9-13(15(3)18(4,16)17)10-14-12-7-5-6-8-12/h11-14H,5-10H2,1-4H3.
What are the key properties of N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide?
N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide has a molecular weight of 276.45 g/mol, XLogP of 1.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentylamino)-4-methylpentan-2-yl]-N-methylmethanesulfonamide is sourced from PubChem (CID 170963522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).