N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide

C10H18N2OS — CID 97358881

IUPACN-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide
SMILESO=C(NCCN[C@@H]1CCSC1)C1CC1
InChIInChI=1S/C10H18N2OS/c13-10(8-1-2-8)12-5-4-11-9-3-6-14-7-9/h8-9,11H,1-7H2,(H,12,13)/t9-/m1/s1
InChIKeyGHMKGOJPSMBMDC-SECBINFHSA-N
MW214.33 g/mol
LogP0.61
Rot. Bonds5

About N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide

N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide (PubChem CID 97358881) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide
PubChem CID97358881
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC NameN-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide
SMILESO=C(NCCN[C@@H]1CCSC1)C1CC1
InChIInChI=1S/C10H18N2OS/c13-10(8-1-2-8)12-5-4-11-9-3-6-14-7-9/h8-9,11H,1-7H2,(H,12,13)/t9-/m1/s1
InChIKeyGHMKGOJPSMBMDC-SECBINFHSA-N
XLogP0.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide 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

3-(thiolan-3-ylamino)propanoic acid
CID 43139948
5-(thiolan-3-ylamino)pentanamide
CID 106233737
N-[2-[[(1S,3R)-3-methylcyclopentyl]amino]ethyl]cyclopropanecarboxamide
CID 97357833
N-(2-pyrrolidin-1-ylethyl)thiolan-3-amine
CID 43181582
2-[2-(thiolane-3-carbonylamino)ethoxy]acetic acid
CID 79457787
N-[2-[(4-methoxycyclohexyl)amino]ethyl]cyclopropanecarboxamide
CID 113422916
4-[(thiolan-3-ylamino)methyl]cyclohexane-1-carboxylic acid
CID 79532658
N-[2-(cycloheptylamino)ethyl]-1,4-dithiane-2-carboxamide
CID 91645418
(3S)-N-(2-piperidin-1-ylethyl)thiolan-3-amine
CID 758325
N-[2-[(4-propylcyclohexyl)amino]ethyl]cyclopropanecarboxamide
CID 113218943
N-[2-[(3-ethylcyclopentyl)amino]ethyl]cyclopropanecarboxamide
CID 115651444
N-(2-oxopropyl)thiolane-3-carboxamide
CID 64997229

Frequently Asked Questions

What is the IUPAC name of N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide (CID 97358881) is N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide is O=C(NCCN[C@@H]1CCSC1)C1CC1.
What is the InChIKey of N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide?
The InChIKey is GHMKGOJPSMBMDC-SECBINFHSA-N. The full InChI is InChI=1S/C10H18N2OS/c13-10(8-1-2-8)12-5-4-11-9-3-6-14-7-9/h8-9,11H,1-7H2,(H,12,13)/t9-/m1/s1.
What are the key properties of N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide?
N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide has a molecular weight of 214.33 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[(3R)-thiolan-3-yl]amino]ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 97358881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).