N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine

C14H23NS — CID 60819375

IUPACN-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccsc1)C1CCCCC1
InChIInChI=1S/C14H23NS/c1-2-9-15-14(13-8-10-16-11-13)12-6-4-3-5-7-12/h8,10-12,14-15H,2-7,9H2,1H3
InChIKeyVGAYWKTZZIKHSC-UHFFFAOYSA-N
MW237.41 g/mol
LogP4.37
Rot. Bonds5

About N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine

N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine (PubChem CID 60819375) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine
PubChem CID60819375
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC NameN-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccsc1)C1CCCCC1
InChIInChI=1S/C14H23NS/c1-2-9-15-14(13-8-10-16-11-13)12-6-4-3-5-7-12/h8,10-12,14-15H,2-7,9H2,1H3
InChIKeyVGAYWKTZZIKHSC-UHFFFAOYSA-N
XLogP4.37
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclooctyl(thiophen-3-yl)methyl]propan-1-amine
CID 80611349
N-[cyclobutyl(thiophen-3-yl)methyl]propan-1-amine
CID 65104762
N-[(4-tert-butylcyclohexyl)-thiophen-3-ylmethyl]propan-1-amine
CID 65415541
N-[cyclohexyl-(4-ethylphenyl)methyl]propan-1-amine
CID 43496590
N-[cyclooctyl-(5-methylthiophen-3-yl)methyl]propan-1-amine
CID 80609279
N-[(5-methyloxolan-2-yl)-thiophen-3-ylmethyl]propan-1-amine
CID 104988409
4-[cycloheptyl(propylamino)methyl]-N,N-dimethylaniline
CID 105176331
N-[cyclohexyl-(3,5-dichlorophenyl)methyl]propan-1-amine
CID 114981576
N-[(4-butylphenyl)-cyclohexylmethyl]propan-1-amine
CID 63503869
N-[cycloheptyl-(3,4,5-trifluorophenyl)methyl]propan-1-amine
CID 82932686
N-[(4-bromo-3-methylphenyl)-cycloheptylmethyl]propan-1-amine
CID 105027651
N-[cyclohexyl-(4-cyclopropyloxyphenyl)methyl]propan-1-amine
CID 114519278

Frequently Asked Questions

What is the IUPAC name of N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine?
The IUPAC name of N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine (CID 60819375) is N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine?
The canonical SMILES for N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine is CCCNC(c1ccsc1)C1CCCCC1.
What is the InChIKey of N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine?
The InChIKey is VGAYWKTZZIKHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-2-9-15-14(13-8-10-16-11-13)12-6-4-3-5-7-12/h8,10-12,14-15H,2-7,9H2,1H3.
What are the key properties of N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine?
N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine has a molecular weight of 237.41 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclohexyl(thiophen-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 60819375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).