1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine

C9H14N2S — CID 65460029

IUPAC1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine
SMILESNC1(CNCc2ccsc2)CC1
InChIInChI=1S/C9H14N2S/c10-9(2-3-9)7-11-5-8-1-4-12-6-8/h1,4,6,11H,2-3,5,7,10H2
InChIKeyWPNZXUDVETVYMJ-UHFFFAOYSA-N
MW182.29 g/mol
LogP1.33
Rot. Bonds4

About 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine

1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine (PubChem CID 65460029) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine
PubChem CID65460029
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine
SMILESNC1(CNCc2ccsc2)CC1
InChIInChI=1S/C9H14N2S/c10-9(2-3-9)7-11-5-8-1-4-12-6-8/h1,4,6,11H,2-3,5,7,10H2
InChIKeyWPNZXUDVETVYMJ-UHFFFAOYSA-N
XLogP1.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(thiophen-3-ylmethylamino)methyl]oxolan-3-amine
CID 64891433
1-[(thiophen-3-ylmethylamino)methyl]cyclopentan-1-ol
CID 63932881
N-[(1-methylcyclobutyl)methyl]-1-thiophen-3-ylmethanamine;hydrochloride
CID 115680477
N-[(1-propylcyclopropyl)methyl]-1-thiophen-3-ylmethanamine
CID 115696320
1-(2-thiophen-3-ylethyl)cyclopropan-1-amine
CID 66025535
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-thiophen-3-ylmethanamine
CID 115735920
2,6-dichloro-4-[(thiophen-3-ylmethylamino)methyl]aniline
CID 82841230
4-ethyl-1-(thiophen-3-ylmethyl)cyclohexan-1-amine
CID 62621420
2-methyl-N'-(thiophen-3-ylmethyl)butane-1,4-diamine
CID 81079572
N-(thiophen-3-ylmethyl)-N',N'-bis[2-(thiophen-3-ylmethylamino)ethyl]ethane-1,2-diamine
CID 100933177
1-(aminomethyl)-N-(thiophen-3-ylmethyl)cyclopentane-1-carboxamide
CID 81489545
N-[(3-methylthiophen-2-yl)methyl]-1-thiophen-3-ylmethanamine
CID 60744110

Frequently Asked Questions

What is the IUPAC name of 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine?
The IUPAC name of 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine (CID 65460029) is 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine is NC1(CNCc2ccsc2)CC1.
What is the InChIKey of 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine?
The InChIKey is WPNZXUDVETVYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c10-9(2-3-9)7-11-5-8-1-4-12-6-8/h1,4,6,11H,2-3,5,7,10H2.
What are the key properties of 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine?
1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine has a molecular weight of 182.29 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(thiophen-3-ylmethylamino)methyl]cyclopropan-1-amine is sourced from PubChem (CID 65460029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).