N-methylpyrrol-1-amine

C5H8N2 — CID 14232103

IUPACN-methylpyrrol-1-amine
SMILESCNn1cccc1
InChIInChI=1S/C5H8N2/c1-6-7-4-2-3-5-7/h2-6H,1H3
InChIKeyXDBORIMSNLCXQK-UHFFFAOYSA-N
MW96.13 g/mol
LogP0.66
Rot. Bonds1

About N-methylpyrrol-1-amine

N-methylpyrrol-1-amine (PubChem CID 14232103) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is N-methylpyrrol-1-amine.

Molecular Properties

Compound NameN-methylpyrrol-1-amine
PubChem CID14232103
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC NameN-methylpyrrol-1-amine
SMILESCNn1cccc1
InChIInChI=1S/C5H8N2/c1-6-7-4-2-3-5-7/h2-6H,1H3
InChIKeyXDBORIMSNLCXQK-UHFFFAOYSA-N
XLogP0.66
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Ethylpyrrole
CID 185226
1-Aminopyrrole
CID 136589
2-(1H-pyrrol-1-yl)ethan-1-amine
CID 2763816
1-(Dimethylamino)pyrrole
CID 573527
3-(1H-pyrrol-1-yl)propan-1-amine
CID 4585582
1,1'-Bi-1H-pyrrole
CID 142298
1H-Pyrrole, 1-propyl-
CID 521329
4-(1H-pyrrol-1-yl)butan-1-amine
CID 24265151
(1-methyl-1H-pyrrol-3-yl)methanamine
CID 55254375
methyl(2-(1H-pyrrol-1-yl)ethyl)amine
CID 59730499
3-methyl-1H-pyrrol-1-amine
CID 119082985
(1-ethyl-1H-pyrrol-3-yl)methanamine
CID 66407752

Frequently Asked Questions

What is the IUPAC name of N-methylpyrrol-1-amine?
The IUPAC name of N-methylpyrrol-1-amine (CID 14232103) is N-methylpyrrol-1-amine.
What is the SMILES notation for N-methylpyrrol-1-amine?
The canonical SMILES for N-methylpyrrol-1-amine is CNn1cccc1.
What is the InChIKey of N-methylpyrrol-1-amine?
The InChIKey is XDBORIMSNLCXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2/c1-6-7-4-2-3-5-7/h2-6H,1H3.
What are the key properties of N-methylpyrrol-1-amine?
N-methylpyrrol-1-amine has a molecular weight of 96.13 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpyrrol-1-amine is sourced from PubChem (CID 14232103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).