[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine

C10H15ClN2S — CID 116943814

IUPAC[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine
SMILESNCC1(C(N)c2ccc(Cl)s2)CCC1
InChIInChI=1S/C10H15ClN2S/c11-8-3-2-7(14-8)9(13)10(6-12)4-1-5-10/h2-3,9H,1,4-6,12-13H2
InChIKeyIIEZHDUKUGYBLI-UHFFFAOYSA-N
MW230.76 g/mol
LogP2.53
Rot. Bonds3

About [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine

[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine (PubChem CID 116943814) has the molecular formula C10H15ClN2S and a molecular weight of 230.76 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine
PubChem CID116943814
Molecular FormulaC10H15ClN2S
Molecular Weight230.76 g/mol
Exact Mass230.06
IUPAC Name[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine
SMILESNCC1(C(N)c2ccc(Cl)s2)CCC1
InChIInChI=1S/C10H15ClN2S/c11-8-3-2-7(14-8)9(13)10(6-12)4-1-5-10/h2-3,9H,1,4-6,12-13H2
InChIKeyIIEZHDUKUGYBLI-UHFFFAOYSA-N
XLogP2.53
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.76
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(aminomethyl)cyclopentyl]-(5-chlorothiophen-2-yl)methanol
CID 79137693
(5-chlorothiophen-2-yl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943525
[4-(aminomethyl)oxan-4-yl]-(5-chlorothiophen-2-yl)methanol
CID 79138820
[1-(aminomethyl)cyclobutyl]-phenylmethanamine
CID 116943782
[(5-chlorothiophen-2-yl)-[1-(2-methylpropyl)cyclopentyl]methyl]hydrazine
CID 105328233
[1-(aminomethyl)-4-ethylcyclohexyl]-(5-chlorothiophen-2-yl)methanol
CID 79137694
[1-(aminomethyl)cyclobutyl]-(3-chloro-4-fluorophenyl)methanamine
CID 116943859
(1S)-1-(5-chlorothiophen-2-yl)propane-1,3-diamine;hydrochloride
CID 171220102
1-(5-chlorothiophen-2-yl)-2,2-dimethylbutan-1-amine
CID 62679931
[1-(aminomethyl)cyclobutyl]-(3-methylthiophen-2-yl)methanamine
CID 116943916
1-(5-chlorothiophen-2-yl)-N-methyl-1-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116958541
[1-[(5-chlorothiophen-2-yl)-(methylamino)methyl]cyclopropyl]methanol
CID 116958259

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine?
The IUPAC name of [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine (CID 116943814) is [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine is NCC1(C(N)c2ccc(Cl)s2)CCC1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine?
The InChIKey is IIEZHDUKUGYBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2S/c11-8-3-2-7(14-8)9(13)10(6-12)4-1-5-10/h2-3,9H,1,4-6,12-13H2.
What are the key properties of [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine?
[1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine has a molecular weight of 230.76 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]-(5-chlorothiophen-2-yl)methanamine is sourced from PubChem (CID 116943814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).