2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine

C17H30N2S — CID 106605144

IUPAC2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
SMILESCC(C)CN(CC1CCCN1)C(c1cccs1)C(C)C
InChIInChI=1S/C17H30N2S/c1-13(2)11-19(12-15-7-5-9-18-15)17(14(3)4)16-8-6-10-20-16/h6,8,10,13-15,17-18H,5,7,9,11-12H2,1-4H3
InChIKeyUKDKNKQMYGEDRJ-UHFFFAOYSA-N
MW294.51 g/mol
LogP4.16
Rot. Bonds7

About 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine

2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine (PubChem CID 106605144) has the molecular formula C17H30N2S and a molecular weight of 294.51 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
PubChem CID106605144
Molecular FormulaC17H30N2S
Molecular Weight294.51 g/mol
Exact Mass294.21
IUPAC Name2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
SMILESCC(C)CN(CC1CCCN1)C(c1cccs1)C(C)C
InChIInChI=1S/C17H30N2S/c1-13(2)11-19(12-15-7-5-9-18-15)17(14(3)4)16-8-6-10-20-16/h6,8,10,13-15,17-18H,5,7,9,11-12H2,1-4H3
InChIKeyUKDKNKQMYGEDRJ-UHFFFAOYSA-N
XLogP4.16
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-thiophen-2-ylpropyl)pyrrolidine
CID 112715427
N-ethyl-N-(piperidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 106622507
N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylethanamine
CID 71637827
N-[1-(5-ethylthiophen-2-yl)ethyl]-2-methyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106605605
2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pentan-3-amine
CID 106605357
(2R)-2-[[(1S)-1-thiophen-2-ylethoxy]methyl]pyrrolidine
CID 97162429
N-(2-methylpropyl)-N-[[(2S)-pyrrolidin-2-yl]methyl]pentan-3-amine
CID 104870302
N-[1-(4-chlorophenyl)ethyl]-2-methyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106605425
2-methyl-N-(piperidin-4-ylmethyl)-N-propyl-1-thiophen-2-ylpropan-1-amine
CID 79715760
2-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106605484
N-(cyclopropylmethyl)-2-methyl-1-phenyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106604235
2-pyrrolidin-2-yl-1-thiophen-2-ylethanamine
CID 116935934

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine?
The IUPAC name of 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine (CID 106605144) is 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine is CC(C)CN(CC1CCCN1)C(c1cccs1)C(C)C.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine?
The InChIKey is UKDKNKQMYGEDRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2S/c1-13(2)11-19(12-15-7-5-9-18-15)17(14(3)4)16-8-6-10-20-16/h6,8,10,13-15,17-18H,5,7,9,11-12H2,1-4H3.
What are the key properties of 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine?
2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine has a molecular weight of 294.51 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 106605144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).