N,N-diethyl-2-methyl-3H-thiophen-2-amine

C9H17NS — CID 57277605

IUPACN,N-diethyl-2-methyl-3H-thiophen-2-amine
SMILESCCN(CC)C1(C)CC=CS1
InChIInChI=1S/C9H17NS/c1-4-10(5-2)9(3)7-6-8-11-9/h6,8H,4-5,7H2,1-3H3
InChIKeyFAWZEMOYWOVSGZ-UHFFFAOYSA-N
MW171.31 g/mol
LogP2.69
Rot. Bonds3

About N,N-diethyl-2-methyl-3H-thiophen-2-amine

N,N-diethyl-2-methyl-3H-thiophen-2-amine (PubChem CID 57277605) has the molecular formula C9H17NS and a molecular weight of 171.31 g/mol. Its IUPAC name is N,N-diethyl-2-methyl-3H-thiophen-2-amine.

Molecular Properties

Compound NameN,N-diethyl-2-methyl-3H-thiophen-2-amine
PubChem CID57277605
Molecular FormulaC9H17NS
Molecular Weight171.31 g/mol
Exact Mass171.11
IUPAC NameN,N-diethyl-2-methyl-3H-thiophen-2-amine
SMILESCCN(CC)C1(C)CC=CS1
InChIInChI=1S/C9H17NS/c1-4-10(5-2)9(3)7-6-8-11-9/h6,8H,4-5,7H2,1-3H3
InChIKeyFAWZEMOYWOVSGZ-UHFFFAOYSA-N
XLogP2.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.31
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-2-methyl-3H-thiophen-2-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

N,N-dimethyl-2,3-dihydrothiophen-2-amine
CID 18974873
N,N,2-trimethyl-3H-thiophen-2-amine
CID 56978141
N-ethyl-N-[(2-methyl-3H-thiophen-2-yl)methyl]ethanamine
CID 57000948
N-ethyl-N-[(2-methyl-2,3-dihydrothiophen-3-yl)methyl]ethanamine
CID 57082603
2,2,3,4-Tetrakis(prop-2-enyl)-1,3-thiazolidine
CID 67377688
(7Z)-2,3,4-trimethyl-2,3,5,6-tetrahydro-1,4-thiazocine
CID 68315571
2,3,4-Trimethyl-2,3,5,6-tetrahydro-1,4-thiazocine
CID 77476549
N,N-dimethyl-5-methylsulfanylpent-1-en-3-amine
CID 88543479
N-ethyl-N-methyl-5-methylsulfanylpent-1-en-3-amine
CID 88870045
5-methylsulfanyl-N,N-dipropylpent-1-en-3-amine
CID 88885670
N-ethyl-N-[ethyl(dimethyl)-lambda4-sulfanyl]pent-4-en-2-amine
CID 123327137
3-Methyl-4-prop-2-enyl-1,3-thiazolidine
CID 123679768

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-methyl-3H-thiophen-2-amine?
The IUPAC name of N,N-diethyl-2-methyl-3H-thiophen-2-amine (CID 57277605) is N,N-diethyl-2-methyl-3H-thiophen-2-amine.
What is the SMILES notation for N,N-diethyl-2-methyl-3H-thiophen-2-amine?
The canonical SMILES for N,N-diethyl-2-methyl-3H-thiophen-2-amine is CCN(CC)C1(C)CC=CS1.
What is the InChIKey of N,N-diethyl-2-methyl-3H-thiophen-2-amine?
The InChIKey is FAWZEMOYWOVSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NS/c1-4-10(5-2)9(3)7-6-8-11-9/h6,8H,4-5,7H2,1-3H3.
What are the key properties of N,N-diethyl-2-methyl-3H-thiophen-2-amine?
N,N-diethyl-2-methyl-3H-thiophen-2-amine has a molecular weight of 171.31 g/mol, XLogP of 2.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-methyl-3H-thiophen-2-amine is sourced from PubChem (CID 57277605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).