N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine

C8H12N2 — CID 123405050

IUPACN-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine
SMILESC=C(C)N(C)c1cc[nH]c1
InChIInChI=1S/C8H12N2/c1-7(2)10(3)8-4-5-9-6-8/h4-6,9H,1H2,2-3H3
InChIKeyQOQUBWGLHCZIHI-UHFFFAOYSA-N
MW136.20 g/mol
LogP1.98
Rot. Bonds2

About N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine

N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine (PubChem CID 123405050) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine.

Molecular Properties

Compound NameN-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine
PubChem CID123405050
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC NameN-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine
SMILESC=C(C)N(C)c1cc[nH]c1
InChIInChI=1S/C8H12N2/c1-7(2)10(3)8-4-5-9-6-8/h4-6,9H,1H2,2-3H3
InChIKeyQOQUBWGLHCZIHI-UHFFFAOYSA-N
XLogP1.98
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-amino-N,4-dimethyl-N-(1H-pyrrol-3-yl)pentanamide
CID 115157553
3-methyl-3-[methyl(1H-pyrrol-3-yl)amino]butanoic acid
CID 117042356
4-[methyl(1H-pyrrol-3-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 115165543
3-prop-1-en-2-yl-1H-pyrrole
CID 10898669
2-[4-[methyl(1H-pyrrol-3-yl)carbamoyl]cyclohexyl]acetic acid
CID 115150963
4-(2-aminoethyl)-N-methyl-N-(1H-pyrrol-3-yl)cyclohexane-1-carboxamide
CID 115151099
4-[methyl(1H-pyrrol-3-yl)amino]cyclohexan-1-ol
CID 115149437
N-[4-(aminomethyl)phenyl]-N-methyl-1H-pyrrol-3-amine
CID 117041628
1-N,3-dimethyl-1-N-(1H-pyrrol-3-yl)butane-1,3-diamine
CID 115200501
3-cyano-N-methyl-N-(1H-pyrrol-3-yl)oxetane-3-carboxamide
CID 115184653
N-methyl-N-(1H-pyrrol-3-yl)piperidine-3-carboxamide
CID 115159892
3-[methyl(1H-pyrrol-3-yl)amino]cyclopentan-1-ol
CID 138595567

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine?
The IUPAC name of N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine (CID 123405050) is N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine.
What is the SMILES notation for N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine?
The canonical SMILES for N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine is C=C(C)N(C)c1cc[nH]c1.
What is the InChIKey of N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine?
The InChIKey is QOQUBWGLHCZIHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-7(2)10(3)8-4-5-9-6-8/h4-6,9H,1H2,2-3H3.
What are the key properties of N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine?
N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine has a molecular weight of 136.20 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-1-en-2-yl-1H-pyrrol-3-amine is sourced from PubChem (CID 123405050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).