5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole

C10H17N — CID 123761625

IUPAC5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole
SMILESCCC1CC1CC1=NCCC1
InChIInChI=1S/C10H17N/c1-2-8-6-9(8)7-10-4-3-5-11-10/h8-9H,2-7H2,1H3
InChIKeyPJEPLCMJUBUBJL-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.66
Rot. Bonds3

About 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole

5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole (PubChem CID 123761625) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole.

Molecular Properties

Compound Name5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole
PubChem CID123761625
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole
SMILESCCC1CC1CC1=NCCC1
InChIInChI=1S/C10H17N/c1-2-8-6-9(8)7-10-4-3-5-11-10/h8-9H,2-7H2,1H3
InChIKeyPJEPLCMJUBUBJL-UHFFFAOYSA-N
XLogP2.66
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[(1R,2R)-2-ethylcyclopropyl]methyl]-2,3,4,5-tetrahydropyridin-6-amine
CID 130847853
5-(2,2-dimethylpropyl)-3,4-dihydro-2H-pyrrole
CID 155095468
1-ethyl-2-[2-(2-methylcyclopropyl)ethyl]cyclopropane
CID 123992340
N-[(2-ethylcyclopropyl)methyl]-N-(pyridin-4-ylmethyl)ethanamine
CID 143613245
1-[[(1R,2R)-2-ethylcyclopropyl]methyl]triazol-4-amine
CID 165472993
cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814
cis-(1R,2S)-1-butyl-2-ethylcyclopropane
CID 6427612
trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 168764244
N-ethyl-3,4-dihydro-2H-pyrrol-5-amine;hydrochloride
CID 67553216
1-ethyl-2-(2-methylsulfanylethyl)cyclopropane
CID 123992734
1-[(1S,2S)-2-ethylcyclopropyl]propan-2-ol
CID 67160266
3-chloro-4-[(2-ethylcyclopropyl)methyl]-5-methyl-1,2,4-triazole
CID 130921136

Frequently Asked Questions

What is the IUPAC name of 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole?
The IUPAC name of 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole (CID 123761625) is 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole.
What is the SMILES notation for 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole?
The canonical SMILES for 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole is CCC1CC1CC1=NCCC1.
What is the InChIKey of 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole?
The InChIKey is PJEPLCMJUBUBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-2-8-6-9(8)7-10-4-3-5-11-10/h8-9H,2-7H2,1H3.
What are the key properties of 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole?
5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole has a molecular weight of 151.25 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-ethylcyclopropyl)methyl]-3,4-dihydro-2H-pyrrole is sourced from PubChem (CID 123761625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).