4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine

C16H27NS — CID 43432822

IUPAC4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine
SMILESCCCC1CCC(NC(C)Cc2cccs2)CC1
InChIInChI=1S/C16H27NS/c1-3-5-14-7-9-15(10-8-14)17-13(2)12-16-6-4-11-18-16/h4,6,11,13-15,17H,3,5,7-10,12H2,1-2H3
InChIKeyZNZMUJHLIUPFPJ-UHFFFAOYSA-N
MW265.47 g/mol
LogP4.63
Rot. Bonds6

About 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine

4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine (PubChem CID 43432822) has the molecular formula C16H27NS and a molecular weight of 265.47 g/mol. Its IUPAC name is 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine
PubChem CID43432822
Molecular FormulaC16H27NS
Molecular Weight265.47 g/mol
Exact Mass265.19
IUPAC Name4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine
SMILESCCCC1CCC(NC(C)Cc2cccs2)CC1
InChIInChI=1S/C16H27NS/c1-3-5-14-7-9-15(10-8-14)17-13(2)12-16-6-4-11-18-16/h4,6,11,13-15,17H,3,5,7-10,12H2,1-2H3
InChIKeyZNZMUJHLIUPFPJ-UHFFFAOYSA-N
XLogP4.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.47
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-thiophen-2-ylpropan-2-yl)cyclopropanamine
CID 82262604
4-(1-thiophen-2-ylpropan-2-ylamino)cyclohexan-1-ol
CID 103904586
4-methyl-N-(1-thiophen-2-ylpropan-2-yl)cycloheptan-1-amine
CID 65081242
N-(2-methyl-1-thiophen-2-ylpropyl)-4-propylcyclohexan-1-amine
CID 43225917
N-[1-(5-methylthiophen-2-yl)propan-2-yl]-4-propylcycloheptan-1-amine
CID 65091722
ethyl 4-(1-thiophen-2-ylpropan-2-ylamino)piperidine-1-carboxylate
CID 43783023
4-[2-[(4-propylcyclohexyl)amino]propyl]phenol
CID 78943354
4-propyl-N-(1-thiophen-2-ylbutyl)cycloheptan-1-amine
CID 65091558
1,2-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)piperidin-4-amine
CID 81302365
N-propyl-1-thiophen-2-ylpropan-2-amine
CID 43692824
4-propyl-N-(1-thiophen-3-ylethyl)cyclohexan-1-amine
CID 63454289
N-[(1R)-1-(furan-2-yl)ethyl]-4-propylcyclohexan-1-amine
CID 81403874

Frequently Asked Questions

What is the IUPAC name of 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine?
The IUPAC name of 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine (CID 43432822) is 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine?
The canonical SMILES for 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine is CCCC1CCC(NC(C)Cc2cccs2)CC1.
What is the InChIKey of 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine?
The InChIKey is ZNZMUJHLIUPFPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NS/c1-3-5-14-7-9-15(10-8-14)17-13(2)12-16-6-4-11-18-16/h4,6,11,13-15,17H,3,5,7-10,12H2,1-2H3.
What are the key properties of 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine?
4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine has a molecular weight of 265.47 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-N-(1-thiophen-2-ylpropan-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 43432822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).