1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine

C12H19NS — CID 104866462

IUPAC1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine
SMILESCC(CC1CC1)N[C@@H](C)c1cccs1
InChIInChI=1S/C12H19NS/c1-9(8-11-5-6-11)13-10(2)12-4-3-7-14-12/h3-4,7,9-11,13H,5-6,8H2,1-2H3/t9?,10-/m0/s1
InChIKeyZBIOKJWRVUBSKB-AXDSSHIGSA-N
MW209.36 g/mol
LogP3.59
Rot. Bonds5

About 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine

1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine (PubChem CID 104866462) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine
PubChem CID104866462
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine
SMILESCC(CC1CC1)N[C@@H](C)c1cccs1
InChIInChI=1S/C12H19NS/c1-9(8-11-5-6-11)13-10(2)12-4-3-7-14-12/h3-4,7,9-11,13H,5-6,8H2,1-2H3/t9?,10-/m0/s1
InChIKeyZBIOKJWRVUBSKB-AXDSSHIGSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine with MolForge

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Related Compounds

1-cyclopropyl-N-[phenyl(thiophen-2-yl)methyl]propan-2-amine
CID 115707556
1-cyclopropyl-N-(1,2-dithiophen-2-ylethyl)propan-2-amine
CID 63989311
methyl 3-(1-cyclopropylpropan-2-ylamino)-3-thiophen-2-ylpropanoate
CID 113489791
1-methoxy-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine
CID 81399226
2,6-dimethyl-N-(1-thiophen-2-ylethyl)heptan-4-amine
CID 43104723
2-cyclopropyl-2-[[(1R)-1-thiophen-2-ylethyl]amino]acetic acid
CID 103257847
4-methoxy-N-[(1S)-1-thiophen-2-ylethyl]butan-2-amine
CID 81398885
1-(2-methylpropoxy)-N-(1-thiophen-2-ylethyl)propan-2-amine
CID 115889318
N-[(1R)-1-(2-chlorophenyl)ethyl]-1-cyclopropylpropan-2-amine
CID 104866435
N-[(1S)-1-(2-bromophenyl)ethyl]-1-cyclopropylpropan-2-amine
CID 103906303
2-(1-thiophen-2-ylethylamino)butan-1-ol
CID 43207104
N-[2-(cyclopropylmethoxy)ethyl]-1-thiophen-2-ylethanamine
CID 62598016

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine?
The IUPAC name of 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine (CID 104866462) is 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine?
The canonical SMILES for 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine is CC(CC1CC1)N[C@@H](C)c1cccs1.
What is the InChIKey of 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine?
The InChIKey is ZBIOKJWRVUBSKB-AXDSSHIGSA-N. The full InChI is InChI=1S/C12H19NS/c1-9(8-11-5-6-11)13-10(2)12-4-3-7-14-12/h3-4,7,9-11,13H,5-6,8H2,1-2H3/t9?,10-/m0/s1.
What are the key properties of 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine?
1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine has a molecular weight of 209.36 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1S)-1-thiophen-2-ylethyl]propan-2-amine is sourced from PubChem (CID 104866462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).