N-(2-pyridin-2-ylethyl)pyrrol-1-amine

C11H13N3 — CID 79100287

IUPACN-(2-pyridin-2-ylethyl)pyrrol-1-amine
SMILESc1ccc(CCNn2cccc2)nc1
InChIInChI=1S/C11H13N3/c1-2-7-12-11(5-1)6-8-13-14-9-3-4-10-14/h1-5,7,9-10,13H,6,8H2
InChIKeyQMUXUHVQDYHXCA-UHFFFAOYSA-N
MW187.25 g/mol
LogP1.67
Rot. Bonds4

About N-(2-pyridin-2-ylethyl)pyrrol-1-amine

N-(2-pyridin-2-ylethyl)pyrrol-1-amine (PubChem CID 79100287) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is N-(2-pyridin-2-ylethyl)pyrrol-1-amine.

Molecular Properties

Compound NameN-(2-pyridin-2-ylethyl)pyrrol-1-amine
PubChem CID79100287
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC NameN-(2-pyridin-2-ylethyl)pyrrol-1-amine
SMILESc1ccc(CCNn2cccc2)nc1
InChIInChI=1S/C11H13N3/c1-2-7-12-11(5-1)6-8-13-14-9-3-4-10-14/h1-5,7,9-10,13H,6,8H2
InChIKeyQMUXUHVQDYHXCA-UHFFFAOYSA-N
XLogP1.67
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-pyridin-2-ylethanamine dichloride
CID 45114105
N-methyl-2-pyridin-2-ylethanamine;hydroiodide
CID 135260552
2,6-dimethyl-N-(2-pyridin-2-ylethyl)piperidin-1-amine
CID 83013889
2-pyridin-2-yl-N-(trideuterio(113C)methyl)ethanamine
CID 163322530
N-(2-pyridin-2-ylethyl)pyrazin-2-amine
CID 28544593
2-pyridin-2-yl-N-[2-[2-(2-pyridin-2-ylethylamino)ethyldisulfanyl]ethyl]ethanamine
CID 101109360
2-(14-pyridin-2-yltetradecyl)pyridine
CID 10594187
2,6-dimethyl-N-(2-pyridin-2-ylethyl)pyrimidin-4-amine
CID 60725788
2-pyridin-2-ylethylcarbamothioic S-acid
CID 87074091
1-(2-pyridin-2-ylethyl)pyridin-2-one
CID 116618481
N'-[2-(2-pyridin-2-ylethylamino)ethyl]ethane-1,2-diamine;tetrahydrochloride
CID 11530463
2-[2-(sulfinoamino)ethyl]pyridine
CID 68546056

Frequently Asked Questions

What is the IUPAC name of N-(2-pyridin-2-ylethyl)pyrrol-1-amine?
The IUPAC name of N-(2-pyridin-2-ylethyl)pyrrol-1-amine (CID 79100287) is N-(2-pyridin-2-ylethyl)pyrrol-1-amine.
What is the SMILES notation for N-(2-pyridin-2-ylethyl)pyrrol-1-amine?
The canonical SMILES for N-(2-pyridin-2-ylethyl)pyrrol-1-amine is c1ccc(CCNn2cccc2)nc1.
What is the InChIKey of N-(2-pyridin-2-ylethyl)pyrrol-1-amine?
The InChIKey is QMUXUHVQDYHXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-7-12-11(5-1)6-8-13-14-9-3-4-10-14/h1-5,7,9-10,13H,6,8H2.
What are the key properties of N-(2-pyridin-2-ylethyl)pyrrol-1-amine?
N-(2-pyridin-2-ylethyl)pyrrol-1-amine has a molecular weight of 187.25 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyridin-2-ylethyl)pyrrol-1-amine is sourced from PubChem (CID 79100287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).