N,N-dimethyl-3H-pyrrol-5-amine

C6H10N2 — CID 174833087

IUPACN,N-dimethyl-3H-pyrrol-5-amine
SMILESCN(C)C1=CCC=N1
InChIInChI=1S/C6H10N2/c1-8(2)6-4-3-5-7-6/h4-5H,3H2,1-2H3
InChIKeyNYIVVPQPROJLAN-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.86
Rot. Bonds1

About N,N-dimethyl-3H-pyrrol-5-amine

N,N-dimethyl-3H-pyrrol-5-amine (PubChem CID 174833087) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is N,N-dimethyl-3H-pyrrol-5-amine.

Molecular Properties

Compound NameN,N-dimethyl-3H-pyrrol-5-amine
PubChem CID174833087
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC NameN,N-dimethyl-3H-pyrrol-5-amine
SMILESCN(C)C1=CCC=N1
InChIInChI=1S/C6H10N2/c1-8(2)6-4-3-5-7-6/h4-5H,3H2,1-2H3
InChIKeyNYIVVPQPROJLAN-UHFFFAOYSA-N
XLogP0.86
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3H-pyrrol-5-amine?
The IUPAC name of N,N-dimethyl-3H-pyrrol-5-amine (CID 174833087) is N,N-dimethyl-3H-pyrrol-5-amine.
What is the SMILES notation for N,N-dimethyl-3H-pyrrol-5-amine?
The canonical SMILES for N,N-dimethyl-3H-pyrrol-5-amine is CN(C)C1=CCC=N1.
What is the InChIKey of N,N-dimethyl-3H-pyrrol-5-amine?
The InChIKey is NYIVVPQPROJLAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-8(2)6-4-3-5-7-6/h4-5H,3H2,1-2H3.
What are the key properties of N,N-dimethyl-3H-pyrrol-5-amine?
N,N-dimethyl-3H-pyrrol-5-amine has a molecular weight of 110.16 g/mol, XLogP of 0.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3H-pyrrol-5-amine is sourced from PubChem (CID 174833087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).