1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine

C14H22N2S — CID 113491658

IUPAC1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
SMILESCC1CC(N[C@H](C)c2cccs2)CN1C1CC1
InChIInChI=1S/C14H22N2S/c1-10-8-12(9-16(10)13-5-6-13)15-11(2)14-4-3-7-17-14/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10?,11-,12?/m1/s1
InChIKeyQBITUKUMKQWACF-MOENNCHZSA-N
MW250.41 g/mol
LogP3.02
Rot. Bonds4

About 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine

1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine (PubChem CID 113491658) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
PubChem CID113491658
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
SMILESCC1CC(N[C@H](C)c2cccs2)CN1C1CC1
InChIInChI=1S/C14H22N2S/c1-10-8-12(9-16(10)13-5-6-13)15-11(2)14-4-3-7-17-14/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10?,11-,12?/m1/s1
InChIKeyQBITUKUMKQWACF-MOENNCHZSA-N
XLogP3.02
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(thiophen-2-yl)methyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115710812
1-cyclopropyl-5-methyl-N-(1-thiophen-2-ylpropyl)pyrrolidin-3-amine
CID 115713136
8-methyl-N-[(1R)-1-thiophen-2-ylethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 81398172
N-[1-(2-bromophenyl)ethyl]-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115704080
(3S,5R)-1-cyclopropyl-N-[(1S)-1-(2,3-dichlorophenyl)ethyl]-5-methylpyrrolidin-3-amine
CID 97322592
1-cyclopropyl-5-methyl-N-[1-(2-methylphenyl)propan-2-yl]pyrrolidin-3-amine
CID 115713788
N-(1-thiophen-2-ylethyl)cyclohexanamine
CID 25219735
1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43182947
3-propan-2-yl-N-(1-thiophen-2-ylethyl)cyclohexan-1-amine
CID 107447910
1-cyclopropyl-N-[1-(1,5-dimethylpyrazol-4-yl)ethyl]-5-methylpyrrolidin-3-amine
CID 115709368
1-cyclopropyl-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrrolidin-3-amine
CID 113365420
N-butan-2-yl-1-cyclopropyl-5-methylpyrrolidin-3-amine
CID 115705721

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The IUPAC name of 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine (CID 113491658) is 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine.
What is the SMILES notation for 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The canonical SMILES for 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine is CC1CC(N[C@H](C)c2cccs2)CN1C1CC1.
What is the InChIKey of 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
The InChIKey is QBITUKUMKQWACF-MOENNCHZSA-N. The full InChI is InChI=1S/C14H22N2S/c1-10-8-12(9-16(10)13-5-6-13)15-11(2)14-4-3-7-17-14/h3-4,7,10-13,15H,5-6,8-9H2,1-2H3/t10?,11-,12?/m1/s1.
What are the key properties of 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine?
1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine has a molecular weight of 250.41 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-5-methyl-N-[(1R)-1-thiophen-2-ylethyl]pyrrolidin-3-amine is sourced from PubChem (CID 113491658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).