N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine

C11H15N3 — CID 79091051

IUPACN-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine
SMILESCCn1ccc(CNn2cccc2)c1
InChIInChI=1S/C11H15N3/c1-2-13-8-5-11(10-13)9-12-14-6-3-4-7-14/h3-8,10,12H,2,9H2,1H3
InChIKeyMUMMRPFNOHQPST-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.05
Rot. Bonds4

About N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine

N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine (PubChem CID 79091051) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine
PubChem CID79091051
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC NameN-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine
SMILESCCn1ccc(CNn2cccc2)c1
InChIInChI=1S/C11H15N3/c1-2-13-8-5-11(10-13)9-12-14-6-3-4-7-14/h3-8,10,12H,2,9H2,1H3
InChIKeyMUMMRPFNOHQPST-UHFFFAOYSA-N
XLogP2.05
TPSA21.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-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-ethoxy-1-(1-ethylpyrrol-3-yl)methanamine
CID 82706620
N-[(1-ethylpyrrol-3-yl)methyl]-2-iodoaniline
CID 66398837
(1R)-N-[(1-ethylpyrrol-3-yl)methyl]-1-(3-methylphenyl)ethanamine
CID 81363119
N-[(4-iodophenyl)methyl]pyrrol-1-amine
CID 79100924
N-[(1-ethylpyrrol-3-yl)methyl]-2-methylbut-3-yn-2-amine
CID 66415005
3-ethyl-N-[(1-ethylpyrrol-3-yl)methyl]pentan-2-amine
CID 66413834
(1S)-N-[(1-ethylpyrrol-3-yl)methyl]-1-(3-fluorophenyl)ethanamine
CID 81365165
2-ethyl-2-[(1-ethylpyrrol-3-yl)methylamino]propane-1,3-diol
CID 103270501
5-[(1-ethylpyrrol-3-yl)methylamino]naphthalen-1-ol
CID 66416710
N-[(1-ethylpyrrol-3-yl)methyl]-2-ethylsulfonylaniline
CID 66416123
6-[(1-ethylpyrrol-3-yl)methylamino]hexan-1-ol
CID 103270570
(1R)-N-[(1-ethylpyrrol-3-yl)methyl]-1-(4-fluorophenyl)ethanamine
CID 81351026

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine?
The IUPAC name of N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine (CID 79091051) is N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine.
What is the SMILES notation for N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine?
The canonical SMILES for N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine is CCn1ccc(CNn2cccc2)c1.
What is the InChIKey of N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine?
The InChIKey is MUMMRPFNOHQPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-2-13-8-5-11(10-13)9-12-14-6-3-4-7-14/h3-8,10,12H,2,9H2,1H3.
What are the key properties of N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine?
N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine has a molecular weight of 189.26 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrol-3-yl)methyl]pyrrol-1-amine is sourced from PubChem (CID 79091051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).