N-methyl-1-(2H-pyrrol-5-yl)methanamine

C6H10N2 — CID 58270092

IUPACN-methyl-1-(2H-pyrrol-5-yl)methanamine
SMILESCNCC1=NCC=C1
InChIInChI=1S/C6H10N2/c1-7-5-6-3-2-4-8-6/h2-3,7H,4-5H2,1H3
InChIKeyPWGMCTUMLLDKFV-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.22
Rot. Bonds2

About N-methyl-1-(2H-pyrrol-5-yl)methanamine

N-methyl-1-(2H-pyrrol-5-yl)methanamine (PubChem CID 58270092) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N-methyl-1-(2H-pyrrol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2H-pyrrol-5-yl)methanamine
PubChem CID58270092
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN-methyl-1-(2H-pyrrol-5-yl)methanamine
SMILESCNCC1=NCC=C1
InChIInChI=1S/C6H10N2/c1-7-5-6-3-2-4-8-6/h2-3,7H,4-5H2,1H3
InChIKeyPWGMCTUMLLDKFV-UHFFFAOYSA-N
XLogP0.22
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(2H-pyrrol-5-yl)methanamine 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

2,6-dihydro-1H-pyridin-1-ium-3-imine
CID 57053248
N,N-dimethyl-1-(2H-pyrrol-5-yl)methanamine
CID 58270096
2H-pyrrol-5-ylmethanamine
CID 67991228
1-(4H-azepin-7-yl)-N-methylmethanamine
CID 91307733
2-imino-N-(2-iminopent-3-enyl)pent-3-en-1-amine
CID 123169571
N-methyl-2-methyliminopent-3-en-1-amine
CID 123205396
(Z)-2-methyliminohex-3-en-1-amine
CID 123256608
1-(2,3-dihydropyridin-6-yl)-N-methylmethanamine
CID 123864517
2-imino-N,N-dimethylpent-3-en-1-amine
CID 123865844
2-imino-N-methylpent-3-en-1-amine
CID 123939168
(Z)-2-methyliminopent-3-en-1-amine
CID 124181230
N-methyl-2-methyliminobut-3-en-1-amine
CID 130440574

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2H-pyrrol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(2H-pyrrol-5-yl)methanamine (CID 58270092) is N-methyl-1-(2H-pyrrol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2H-pyrrol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(2H-pyrrol-5-yl)methanamine is CNCC1=NCC=C1.
What is the InChIKey of N-methyl-1-(2H-pyrrol-5-yl)methanamine?
The InChIKey is PWGMCTUMLLDKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-7-5-6-3-2-4-8-6/h2-3,7H,4-5H2,1H3.
What are the key properties of N-methyl-1-(2H-pyrrol-5-yl)methanamine?
N-methyl-1-(2H-pyrrol-5-yl)methanamine has a molecular weight of 110.16 g/mol, XLogP of 0.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2H-pyrrol-5-yl)methanamine is sourced from PubChem (CID 58270092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).