4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine

C15H25NOS — CID 113414380

IUPAC4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine
SMILESCCCC(NC1CCC(OC)CC1)c1cccs1
InChIInChI=1S/C15H25NOS/c1-3-5-14(15-6-4-11-18-15)16-12-7-9-13(17-2)10-8-12/h4,6,11-14,16H,3,5,7-10H2,1-2H3
InChIKeyKYKSIPAJWJZURD-UHFFFAOYSA-N
MW267.44 g/mol
LogP4.14
Rot. Bonds6

About 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine

4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine (PubChem CID 113414380) has the molecular formula C15H25NOS and a molecular weight of 267.44 g/mol. Its IUPAC name is 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine
PubChem CID113414380
Molecular FormulaC15H25NOS
Molecular Weight267.44 g/mol
Exact Mass267.17
IUPAC Name4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine
SMILESCCCC(NC1CCC(OC)CC1)c1cccs1
InChIInChI=1S/C15H25NOS/c1-3-5-14(15-6-4-11-18-15)16-12-7-9-13(17-2)10-8-12/h4,6,11-14,16H,3,5,7-10H2,1-2H3
InChIKeyKYKSIPAJWJZURD-UHFFFAOYSA-N
XLogP4.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-thiophen-2-ylbutyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64754879
3-ethoxy-N-(1-thiophen-2-ylbutyl)cyclobutan-1-amine
CID 112553091
4-propyl-N-(1-thiophen-2-ylbutyl)cycloheptan-1-amine
CID 65091558
N-(1-thiophen-2-ylbutyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63454457
3-methyl-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine
CID 55194083
methyl 3-(cyclopropylamino)-3-thiophen-2-ylpropanoate
CID 103439049
2-methyl-N-(1-thiophen-2-ylbutyl)thian-3-amine
CID 79957676
N-(1-thiophen-2-ylbutyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79898737
tert-butyl N-[3-(1-thiophen-2-ylbutylamino)cyclobutyl]carbamate
CID 103759595
3-(3-methylphenyl)-N-(1-thiophen-2-ylbutyl)cyclobutan-1-amine
CID 63455867
N-[(1S)-1-thiophen-2-ylbutyl]hydroxylamine
CID 131230047
2-chloro-N-(1-thiophen-2-ylbutyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-4-amine
CID 81252071

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine?
The IUPAC name of 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine (CID 113414380) is 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine.
What is the SMILES notation for 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine?
The canonical SMILES for 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine is CCCC(NC1CCC(OC)CC1)c1cccs1.
What is the InChIKey of 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine?
The InChIKey is KYKSIPAJWJZURD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NOS/c1-3-5-14(15-6-4-11-18-15)16-12-7-9-13(17-2)10-8-12/h4,6,11-14,16H,3,5,7-10H2,1-2H3.
What are the key properties of 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine?
4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine has a molecular weight of 267.44 g/mol, XLogP of 4.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1-thiophen-2-ylbutyl)cyclohexan-1-amine is sourced from PubChem (CID 113414380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).