N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide

C11H21N3OS — CID 106325201

IUPACN-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide
SMILESO=C(CNCCN1CCSCC1)NC1CC1
InChIInChI=1S/C11H21N3OS/c15-11(13-10-1-2-10)9-12-3-4-14-5-7-16-8-6-14/h10,12H,1-9H2,(H,13,15)
InChIKeyKOAARCKUUNTVPF-UHFFFAOYSA-N
MW243.38 g/mol
LogP-0.10
Rot. Bonds6

About N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide

N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide (PubChem CID 106325201) has the molecular formula C11H21N3OS and a molecular weight of 243.38 g/mol. Its IUPAC name is N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide
PubChem CID106325201
Molecular FormulaC11H21N3OS
Molecular Weight243.38 g/mol
Exact Mass243.14
IUPAC NameN-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide
SMILESO=C(CNCCN1CCSCC1)NC1CC1
InChIInChI=1S/C11H21N3OS/c15-11(13-10-1-2-10)9-12-3-4-14-5-7-16-8-6-14/h10,12H,1-9H2,(H,13,15)
InChIKeyKOAARCKUUNTVPF-UHFFFAOYSA-N
XLogP-0.10
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-(2-thiomorpholin-4-ylethylamino)acetamide
CID 106325242
cis-(1R,3S)-3-(2-thiomorpholin-4-ylethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 106326297
N-(cyclopentylmethyl)-2-thiomorpholin-4-ylethanamine
CID 62574718
N-cyclopentyl-2-(2-thiomorpholin-4-ylethylamino)propanamide
CID 106325726
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]propanoic acid
CID 43466674
3-(2-thiomorpholin-4-ylethylamino)propanamide
CID 106325237
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]butanoic acid
CID 43473310
2-(3-aminopropylamino)-N-cyclopropylacetamide
CID 62274184
N-(2,6-difluorophenyl)-2-(2-thiomorpholin-4-ylethylamino)acetamide
CID 106325135
N-[(1-methylpiperidin-4-yl)methyl]-2-thiomorpholin-4-ylethanamine
CID 114173752
N-cyclopropyl-4-(2-morpholin-4-ylethylamino)butanamide
CID 79394794
1-cyclopentyl-3-(2-thiomorpholin-4-ylethyl)thiourea
CID 106325042

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide?
The IUPAC name of N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide (CID 106325201) is N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide is O=C(CNCCN1CCSCC1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide?
The InChIKey is KOAARCKUUNTVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3OS/c15-11(13-10-1-2-10)9-12-3-4-14-5-7-16-8-6-14/h10,12H,1-9H2,(H,13,15).
What are the key properties of N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide?
N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide has a molecular weight of 243.38 g/mol, XLogP of -0.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2-thiomorpholin-4-ylethylamino)acetamide is sourced from PubChem (CID 106325201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).