1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine

C10H14ClNOS — CID 83228817

IUPAC1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine
SMILESClc1ccc(CNOC2CCCC2)s1
InChIInChI=1S/C10H14ClNOS/c11-10-6-5-9(14-10)7-12-13-8-3-1-2-4-8/h5-6,8,12H,1-4,7H2
InChIKeyCSUIHJWCSNISIH-UHFFFAOYSA-N
MW231.75 g/mol
LogP3.37
Rot. Bonds4

About 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine

1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine (PubChem CID 83228817) has the molecular formula C10H14ClNOS and a molecular weight of 231.75 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine
PubChem CID83228817
Molecular FormulaC10H14ClNOS
Molecular Weight231.75 g/mol
Exact Mass231.05
IUPAC Name1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine
SMILESClc1ccc(CNOC2CCCC2)s1
InChIInChI=1S/C10H14ClNOS/c11-10-6-5-9(14-10)7-12-13-8-3-1-2-4-8/h5-6,8,12H,1-4,7H2
InChIKeyCSUIHJWCSNISIH-UHFFFAOYSA-N
XLogP3.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.75
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-(4-bromo-5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine
CID 102837218
2-[(5-chlorothiophen-2-yl)methylamino]-1-cyclopentylethanol
CID 111425399
N-[(5-chlorothiophen-2-yl)methyl]-1,1-dioxothian-4-amine
CID 43614830
1-(5-chlorothiophen-2-yl)-N-(2,2,2-trifluoroethoxy)methanamine
CID 82712053
N-[(5-chlorothiophen-2-yl)methyl]-1-methylcyclobutan-1-amine
CID 115765786
(3S)-N-[(5-chlorothiophen-2-yl)methyl]oxan-3-amine
CID 126999806
[5-[(cyclopentyloxyamino)methyl]furan-2-yl]methanol
CID 83229626
4-[(cyclopentyloxyamino)methyl]phenol
CID 83229024
N-cyclopentyloxy-1-(4-methylphenyl)methanamine
CID 83229470
4-[[(5-chlorothiophen-2-yl)methylamino]methyl]cyclohexane-1-carboxylic acid
CID 79532810
N-[6-(5-chlorothiophen-2-yl)hexyl]cyclopropanamine
CID 65308853
trans-(1R,2R)-N-[(5-chlorothiophen-2-yl)methyl]-2-methylcyclopropan-1-amine
CID 94428351

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine?
The IUPAC name of 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine (CID 83228817) is 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine is Clc1ccc(CNOC2CCCC2)s1.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine?
The InChIKey is CSUIHJWCSNISIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNOS/c11-10-6-5-9(14-10)7-12-13-8-3-1-2-4-8/h5-6,8,12H,1-4,7H2.
What are the key properties of 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine?
1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine has a molecular weight of 231.75 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)-N-cyclopentyloxymethanamine is sourced from PubChem (CID 83228817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).