5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine

C10H15ClN2S — CID 115208661

IUPAC5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine
SMILESCN(CC1CCNC1)c1ccc(Cl)s1
InChIInChI=1S/C10H15ClN2S/c1-13(7-8-4-5-12-6-8)10-3-2-9(11)14-10/h2-3,8,12H,4-7H2,1H3
InChIKeyMMITZEVZEACRQW-UHFFFAOYSA-N
MW230.76 g/mol
LogP2.45
Rot. Bonds3

About 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine

5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine (PubChem CID 115208661) has the molecular formula C10H15ClN2S and a molecular weight of 230.76 g/mol. Its IUPAC name is 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine.

Molecular Properties

Compound Name5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine
PubChem CID115208661
Molecular FormulaC10H15ClN2S
Molecular Weight230.76 g/mol
Exact Mass230.06
IUPAC Name5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine
SMILESCN(CC1CCNC1)c1ccc(Cl)s1
InChIInChI=1S/C10H15ClN2S/c1-13(7-8-4-5-12-6-8)10-3-2-9(11)14-10/h2-3,8,12H,4-7H2,1H3
InChIKeyMMITZEVZEACRQW-UHFFFAOYSA-N
XLogP2.45
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.76
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-methyl-N-[(1-methylpiperazin-2-yl)methyl]thiophen-2-amine
CID 115238312
N-(5-chlorothiophen-2-yl)-N-methylpyrrolidin-3-amine
CID 115118693
6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164559
3-[(5-chlorothiophen-2-yl)sulfanylmethyl]pyrrolidine
CID 117033083
N-methyl-N-(pyrrolidin-3-ylmethyl)-1,3-benzothiazol-2-amine
CID 71642311
5-chloro-N-methyl-N-(piperidin-4-ylmethyl)thiophene-2-sulfonamide
CID 79716907
5-chloro-N-methyl-N-(piperazin-1-ylmethyl)thiophen-2-amine
CID 115229873
N,6-dimethyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164558
N-(5-chlorothiophen-2-yl)-N-methylazetidin-3-amine
CID 117040547
N-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]-1,2-benzothiazol-3-amine
CID 97164638
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
1-(5-chlorothiophen-2-yl)-3-pyrrolidin-3-ylpropan-2-one
CID 116583465

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine?
The IUPAC name of 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine (CID 115208661) is 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine.
What is the SMILES notation for 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine?
The canonical SMILES for 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine is CN(CC1CCNC1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine?
The InChIKey is MMITZEVZEACRQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2S/c1-13(7-8-4-5-12-6-8)10-3-2-9(11)14-10/h2-3,8,12H,4-7H2,1H3.
What are the key properties of 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine?
5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine has a molecular weight of 230.76 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine is sourced from PubChem (CID 115208661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).