2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine

C15H25NS — CID 83160239

IUPAC2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine
SMILESCC(C)NCC(C)(CCc1cccs1)C1CC1
InChIInChI=1S/C15H25NS/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h4-5,10,12-13,16H,6-9,11H2,1-3H3
InChIKeyNABUJHBWRUIJKM-UHFFFAOYSA-N
MW251.44 g/mol
LogP4.09
Rot. Bonds7

About 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine

2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine (PubChem CID 83160239) has the molecular formula C15H25NS and a molecular weight of 251.44 g/mol. Its IUPAC name is 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine
PubChem CID83160239
Molecular FormulaC15H25NS
Molecular Weight251.44 g/mol
Exact Mass251.17
IUPAC Name2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine
SMILESCC(C)NCC(C)(CCc1cccs1)C1CC1
InChIInChI=1S/C15H25NS/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h4-5,10,12-13,16H,6-9,11H2,1-3H3
InChIKeyNABUJHBWRUIJKM-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.44
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Launch Full Analysis

Related Compounds

2-cyclopropyl-2-methyl-N-propyl-4-thiophen-2-ylbutan-1-amine
CID 83159233
2-methyl-N-propan-2-yl-2-(thiophen-2-ylmethyl)pentan-1-amine
CID 62725024
N-(2-cyclopropyl-2-methyl-3-thiophen-2-ylpropyl)cyclopropanamine
CID 83159341
1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 115706476
(1R)-1-cyclopentyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 81395803
2-methyl-N,N'-di(propan-2-yl)-2-propyl-N'-(thiophen-2-ylmethyl)propane-1,3-diamine
CID 63492986
N-propan-2-yl-6-thiophen-2-ylhexan-1-amine
CID 65308474
2-[4-bromo-3-(bromomethyl)-3-cyclopentylbutyl]thiophene
CID 112571194
N-(1-cyclopentylethyl)-3-thiophen-2-ylpropan-1-amine
CID 115897402
3-(2-bromophenyl)-2-cyclopropyl-2-methyl-N-propan-2-ylpropan-1-amine
CID 83159961
4-cyclopentyl-N-(thiophen-2-ylmethyl)butan-2-amine
CID 115644666
N-ethyl-2,2-dimethyl-4-thiophen-2-ylbutan-1-amine
CID 63774462

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine?
The IUPAC name of 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine (CID 83160239) is 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine is CC(C)NCC(C)(CCc1cccs1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine?
The InChIKey is NABUJHBWRUIJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NS/c1-12(2)16-11-15(3,13-6-7-13)9-8-14-5-4-10-17-14/h4-5,10,12-13,16H,6-9,11H2,1-3H3.
What are the key properties of 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine?
2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine has a molecular weight of 251.44 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methyl-N-propan-2-yl-4-thiophen-2-ylbutan-1-amine is sourced from PubChem (CID 83160239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).