N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide

C12H20N4O2S — CID 62145867

IUPACN-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)NCC2CCCC2)cn1
InChIInChI=1S/C12H20N4O2S/c1-2-13-12-14-8-11(9-15-12)19(17,18)16-7-10-5-3-4-6-10/h8-10,16H,2-7H2,1H3,(H,13,14,15)
InChIKeyIPFORLHURKKIAA-UHFFFAOYSA-N
MW284.38 g/mol
LogP1.38
Rot. Bonds6

About N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide

N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide (PubChem CID 62145867) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide
PubChem CID62145867
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC NameN-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)NCC2CCCC2)cn1
InChIInChI=1S/C12H20N4O2S/c1-2-13-12-14-8-11(9-15-12)19(17,18)16-7-10-5-3-4-6-10/h8-10,16H,2-7H2,1H3,(H,13,14,15)
InChIKeyIPFORLHURKKIAA-UHFFFAOYSA-N
XLogP1.38
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide 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-(cyclopropylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62150077
N-[(1,1-dioxothiolan-3-yl)methyl]-2-(ethylamino)pyrimidine-5-sulfonamide
CID 62145464
2-(ethylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidine-5-sulfonamide
CID 79359680
2-(ethylamino)-N-(3-ethylcyclohexyl)pyrimidine-5-sulfonamide
CID 64741289
2-(methylamino)-N-[(4-methylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 63244295
2-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 63244262
N-[(1-ethylpiperidin-4-yl)methyl]-2-(methylamino)pyrimidine-5-sulfonamide
CID 62157065
2-chloro-N-[(4-ethylcyclohexyl)methyl]pyrimidine-5-sulfonamide
CID 61053689
2-chloro-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
CID 43456299
2-amino-N-(cyclopropylmethyl)pyrimidine-5-sulfonamide
CID 62150401
5-chloro-N-(cyclopentylmethyl)-6-(propylamino)pyridine-3-sulfonamide
CID 64606620
2-[[2-(ethylamino)pyrimidin-5-yl]sulfonylamino]ethylurea
CID 83115138

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide (CID 62145867) is N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide is CCNc1ncc(S(=O)(=O)NCC2CCCC2)cn1.
What is the InChIKey of N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide?
The InChIKey is IPFORLHURKKIAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-2-13-12-14-8-11(9-15-12)19(17,18)16-7-10-5-3-4-6-10/h8-10,16H,2-7H2,1H3,(H,13,14,15).
What are the key properties of N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide?
N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide has a molecular weight of 284.38 g/mol, XLogP of 1.38, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-2-(ethylamino)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62145867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).