N-propyl-3,4-dihydro-2H-pyrrol-5-amine

C7H14N2 — CID 55207199

IUPACN-propyl-3,4-dihydro-2H-pyrrol-5-amine
SMILESCCCNC1=NCCC1
InChIInChI=1S/C7H14N2/c1-2-5-8-7-4-3-6-9-7/h2-6H2,1H3,(H,8,9)
InChIKeyFMKMRWFQZGEWRD-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.18
Rot. Bonds2

About N-propyl-3,4-dihydro-2H-pyrrol-5-amine

N-propyl-3,4-dihydro-2H-pyrrol-5-amine (PubChem CID 55207199) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-propyl-3,4-dihydro-2H-pyrrol-5-amine.

Molecular Properties

Compound NameN-propyl-3,4-dihydro-2H-pyrrol-5-amine
PubChem CID55207199
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-propyl-3,4-dihydro-2H-pyrrol-5-amine
SMILESCCCNC1=NCCC1
InChIInChI=1S/C7H14N2/c1-2-5-8-7-4-3-6-9-7/h2-6H2,1H3,(H,8,9)
InChIKeyFMKMRWFQZGEWRD-UHFFFAOYSA-N
XLogP1.18
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Imidazoline, 2-ethyl-
CID 13590
2-Imidazoline, 2-propyl-
CID 27291
2-Butyl-2-imidazoline
CID 25284
1H-Imidazole, 2-ethyl-4,5-dihydro-5-methyl-
CID 13604
n-Methyl-3,4,5,6-tetrahydropyridin-2-amine
CID 135458572
N-methyl-3,4-dihydro-2H-pyrrol-5-amine hydrochloride
CID 136277051
N-methylpyrrolidin-2-imine;hydroiodide
CID 136609989
2-Isobutyl-2-imidazoline
CID 12587213
2-Isopropyl-4,5-dihydro-1H-imidazole
CID 535189
1,2-Bis(4,5-dihydro-1h-imidazol-2-yl)ethane
CID 12535969
2-Methyl-1,4,5,6-tetrahydropyrimidine
CID 2771917
Ethanimidamide, N,N'-dibutyl-
CID 11194584

Frequently Asked Questions

What is the IUPAC name of N-propyl-3,4-dihydro-2H-pyrrol-5-amine?
The IUPAC name of N-propyl-3,4-dihydro-2H-pyrrol-5-amine (CID 55207199) is N-propyl-3,4-dihydro-2H-pyrrol-5-amine.
What is the SMILES notation for N-propyl-3,4-dihydro-2H-pyrrol-5-amine?
The canonical SMILES for N-propyl-3,4-dihydro-2H-pyrrol-5-amine is CCCNC1=NCCC1.
What is the InChIKey of N-propyl-3,4-dihydro-2H-pyrrol-5-amine?
The InChIKey is FMKMRWFQZGEWRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-2-5-8-7-4-3-6-9-7/h2-6H2,1H3,(H,8,9).
What are the key properties of N-propyl-3,4-dihydro-2H-pyrrol-5-amine?
N-propyl-3,4-dihydro-2H-pyrrol-5-amine has a molecular weight of 126.20 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3,4-dihydro-2H-pyrrol-5-amine is sourced from PubChem (CID 55207199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).