1-(2-propylpyrrol-2-yl)propan-2-amine

C10H18N2 — CID 57078424

IUPAC1-(2-propylpyrrol-2-yl)propan-2-amine
SMILESCCCC1(CC(C)N)C=CC=N1
InChIInChI=1S/C10H18N2/c1-3-5-10(8-9(2)11)6-4-7-12-10/h4,6-7,9H,3,5,8,11H2,1-2H3
InChIKeyDCRIODYURGVXIP-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.90
Rot. Bonds4

About 1-(2-propylpyrrol-2-yl)propan-2-amine

1-(2-propylpyrrol-2-yl)propan-2-amine (PubChem CID 57078424) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-(2-propylpyrrol-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(2-propylpyrrol-2-yl)propan-2-amine
PubChem CID57078424
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-(2-propylpyrrol-2-yl)propan-2-amine
SMILESCCCC1(CC(C)N)C=CC=N1
InChIInChI=1S/C10H18N2/c1-3-5-10(8-9(2)11)6-4-7-12-10/h4,6-7,9H,3,5,8,11H2,1-2H3
InChIKeyDCRIODYURGVXIP-UHFFFAOYSA-N
XLogP1.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2-Hexylpyrrol-2-yl)hexan-1-amine
CID 57022325
2-(2-Propylpyrrol-2-yl)ethanamine
CID 57077373
N-[2-[2-(2-aminoethyl)pyrrol-2-yl]ethyl]dodecan-1-amine
CID 57254824
(2E)-2-(ethylideneamino)-5-methylnona-2,8-dien-4-amine
CID 89503499
N-methyl-3-(2-methylpyrrol-2-yl)propan-1-amine
CID 90823842
(2R)-2-(2,3-dihydropyridin-2-yl)-4-methylpentan-1-amine
CID 132227948
3-(3-methylbutyl)-2H-pyridine-2,3-diamine
CID 151850261
2-[(2S)-2-methyl-3H-pyridin-2-yl]ethanamine
CID 173495334
(Z,2R,3R)-2-[(3S)-2-ethyl-3,4-dihydro-2H-pyrrol-3-yl]oct-5-en-3-amine
CID 173898841
2,2-Dibutylpyrrole
CID 174882814
2-Cyclopenten-1-amine, N-methyl-4-[2-(methylimino)ethyl]-
CID 12251055

Frequently Asked Questions

What is the IUPAC name of 1-(2-propylpyrrol-2-yl)propan-2-amine?
The IUPAC name of 1-(2-propylpyrrol-2-yl)propan-2-amine (CID 57078424) is 1-(2-propylpyrrol-2-yl)propan-2-amine.
What is the SMILES notation for 1-(2-propylpyrrol-2-yl)propan-2-amine?
The canonical SMILES for 1-(2-propylpyrrol-2-yl)propan-2-amine is CCCC1(CC(C)N)C=CC=N1.
What is the InChIKey of 1-(2-propylpyrrol-2-yl)propan-2-amine?
The InChIKey is DCRIODYURGVXIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-3-5-10(8-9(2)11)6-4-7-12-10/h4,6-7,9H,3,5,8,11H2,1-2H3.
What are the key properties of 1-(2-propylpyrrol-2-yl)propan-2-amine?
1-(2-propylpyrrol-2-yl)propan-2-amine has a molecular weight of 166.27 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-propylpyrrol-2-yl)propan-2-amine is sourced from PubChem (CID 57078424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).