N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine

C12H20N2S — CID 62327409

IUPACN-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
SMILESCC(C)N(Cc1cccs1)C1CCNC1
InChIInChI=1S/C12H20N2S/c1-10(2)14(11-5-6-13-8-11)9-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3
InChIKeyRVGRWBKNYXEWSW-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.32
Rot. Bonds4

About N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine

N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine (PubChem CID 62327409) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
PubChem CID62327409
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC NameN-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine
SMILESCC(C)N(Cc1cccs1)C1CCNC1
InChIInChI=1S/C12H20N2S/c1-10(2)14(11-5-6-13-8-11)9-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3
InChIKeyRVGRWBKNYXEWSW-UHFFFAOYSA-N
XLogP2.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-benzyl-N-propan-2-ylpyrrolidin-3-amine
CID 66569418
N-cyclopropyl-N-(thiophen-2-ylmethyl)azetidin-3-amine
CID 62784619
N-ethyl-N-(thiophen-2-ylmethyl)piperidin-4-amine;dihydrochloride
CID 69497458
trans-(1R,2R)-2-[propan-2-yl(thiophen-2-ylmethyl)amino]cyclopentan-1-ol
CID 102734532
(3R)-N-benzyl-N-propan-2-ylpiperidin-3-amine
CID 66569420
1-N-propan-2-yl-1-N-(thiophen-2-ylmethyl)cycloheptane-1,2-diamine
CID 54946732
2-[cyclopropyl(thiophen-2-ylmethyl)amino]propanoic acid
CID 61448732
N-(piperidin-4-ylmethyl)-N-(2-thiophen-2-ylethyl)propan-2-amine
CID 79713906
N-methyl-N-thiophen-2-ylpyrrolidin-3-amine
CID 115118676
N-methyl-N-piperidin-4-yl-3-thiophen-2-ylpropanamide;hydrochloride
CID 119442471
2-N-cyclopropyl-3-methyl-2-N-(thiophen-2-ylmethyl)pentane-1,2-diamine
CID 54948407
3-[cyclopropyl(thiophen-2-ylmethyl)amino]butanoic acid
CID 61448892

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The IUPAC name of N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine (CID 62327409) is N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The canonical SMILES for N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine is CC(C)N(Cc1cccs1)C1CCNC1.
What is the InChIKey of N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
The InChIKey is RVGRWBKNYXEWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-10(2)14(11-5-6-13-8-11)9-12-4-3-7-15-12/h3-4,7,10-11,13H,5-6,8-9H2,1-2H3.
What are the key properties of N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine?
N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine has a molecular weight of 224.37 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-N-(thiophen-2-ylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 62327409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).