5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole

C10H17N — CID 141432673

IUPAC5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole
SMILESC=C(C)C1=CC(CCC)CN1
InChIInChI=1S/C10H17N/c1-4-5-9-6-10(8(2)3)11-7-9/h6,9,11H,2,4-5,7H2,1,3H3
InChIKeyGHYGRPQHTPOXQF-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.47
Rot. Bonds3

About 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole

5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole (PubChem CID 141432673) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole.

Molecular Properties

Compound Name5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole
PubChem CID141432673
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole
SMILESC=C(C)C1=CC(CCC)CN1
InChIInChI=1S/C10H17N/c1-4-5-9-6-10(8(2)3)11-7-9/h6,9,11H,2,4-5,7H2,1,3H3
InChIKeyGHYGRPQHTPOXQF-UHFFFAOYSA-N
XLogP2.47
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-methyl-3-propylcyclobutene
CID 14434507
5-prop-1-en-2-yl-2,3-dihydro-1H-pyrrole
CID 141083269
3-ethyl-1-prop-1-en-2-ylcyclopentene
CID 90736766
[3-(4-methylpent-2-enyl)-2,3-dihydro-1H-pyrrole-5-carbonyl]azanium
CID 163950449
(2R,4R,5R)-2-propylpiperidine-3,4,5-triol
CID 89224432
N-(3-propylcyclohexa-1,5-dien-1-yl)hydroxylamine
CID 163983354
[(1S)-3-prop-1-en-2-ylcyclohexa-2,4-dien-1-yl]methanamine
CID 167203745
2-methylidene-4-prop-1-en-2-yl-3-propylazetidine
CID 126555441
5-propylcyclohexa-1,3-dien-1-ol
CID 142071341
2-propylaziridine
CID 544792
1-(4-propylcyclohex-2-en-1-yl)ethanone
CID 89128614
3-fluoro-2-methyl-5-propylcyclohexa-1,3-diene
CID 89277390

Frequently Asked Questions

What is the IUPAC name of 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole?
The IUPAC name of 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole (CID 141432673) is 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole.
What is the SMILES notation for 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole?
The canonical SMILES for 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole is C=C(C)C1=CC(CCC)CN1.
What is the InChIKey of 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole?
The InChIKey is GHYGRPQHTPOXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-4-5-9-6-10(8(2)3)11-7-9/h6,9,11H,2,4-5,7H2,1,3H3.
What are the key properties of 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole?
5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole has a molecular weight of 151.25 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-prop-1-en-2-yl-3-propyl-2,3-dihydro-1H-pyrrole is sourced from PubChem (CID 141432673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).