3,5-dimethyl-2H-pyrrol-4-amine

C6H10N2 — CID 159487649

IUPAC3,5-dimethyl-2H-pyrrol-4-amine
SMILESCC1=NCC(C)=C1N
InChIInChI=1S/C6H10N2/c1-4-3-8-5(2)6(4)7/h3,7H2,1-2H3
InChIKeyPUIWOWGPBUDYFV-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.69
Rot. Bonds

About 3,5-dimethyl-2H-pyrrol-4-amine

3,5-dimethyl-2H-pyrrol-4-amine (PubChem CID 159487649) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 3,5-dimethyl-2H-pyrrol-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-2H-pyrrol-4-amine
PubChem CID159487649
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name3,5-dimethyl-2H-pyrrol-4-amine
SMILESCC1=NCC(C)=C1N
InChIInChI=1S/C6H10N2/c1-4-3-8-5(2)6(4)7/h3,7H2,1-2H3
InChIKeyPUIWOWGPBUDYFV-UHFFFAOYSA-N
XLogP0.69
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4,5-dimethyl-2H-pyrrol-3-yl)methanamine
CID 23559255
N,3,5-trimethyl-2H-pyrrol-4-amine
CID 23567631
(Z)-3-methyl-4-methyliminopent-2-en-2-amine
CID 59104563
3-Methyl-4-methyliminopent-2-en-2-amine
CID 72517933
(E)-4-N-ethylidene-3-methylpent-3-ene-2,4-diimine
CID 123915040
(E)-2-(ethylideneamino)-4-iminopent-2-en-3-amine
CID 126599262
(Z)-4-ethylimino-3-methylpent-2-en-2-amine
CID 132246404
(Z)-4-N-ethylidene-3-methylpent-3-ene-2,4-diimine
CID 138532676
(Z)-2-(C,N-dimethylcarbonimidoyl)but-2-ene-1,3-diamine
CID 143502161
(3-methyl-2H-pyrrol-5-yl)methanamine
CID 143608315
4-Ethylimino-3-methylpent-2-en-2-amine
CID 148068041
5-methyl-2H-pyrrol-4-amine
CID 150836723

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2H-pyrrol-4-amine?
The IUPAC name of 3,5-dimethyl-2H-pyrrol-4-amine (CID 159487649) is 3,5-dimethyl-2H-pyrrol-4-amine.
What is the SMILES notation for 3,5-dimethyl-2H-pyrrol-4-amine?
The canonical SMILES for 3,5-dimethyl-2H-pyrrol-4-amine is CC1=NCC(C)=C1N.
What is the InChIKey of 3,5-dimethyl-2H-pyrrol-4-amine?
The InChIKey is PUIWOWGPBUDYFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-4-3-8-5(2)6(4)7/h3,7H2,1-2H3.
What are the key properties of 3,5-dimethyl-2H-pyrrol-4-amine?
3,5-dimethyl-2H-pyrrol-4-amine has a molecular weight of 110.16 g/mol, XLogP of 0.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2H-pyrrol-4-amine is sourced from PubChem (CID 159487649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).