2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol

C14H24N2O — CID 79096939

IUPAC2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol
SMILESCC(C)C(O)c1ccn(CCN2CCCC2)c1
InChIInChI=1S/C14H24N2O/c1-12(2)14(17)13-5-8-16(11-13)10-9-15-6-3-4-7-15/h5,8,11-12,14,17H,3-4,6-7,9-10H2,1-2H3
InChIKeyDGFPESKPOCTJCR-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.27
Rot. Bonds5

About 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol

2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol (PubChem CID 79096939) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol.

Molecular Properties

Compound Name2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol
PubChem CID79096939
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol
SMILESCC(C)C(O)c1ccn(CCN2CCCC2)c1
InChIInChI=1S/C14H24N2O/c1-12(2)14(17)13-5-8-16(11-13)10-9-15-6-3-4-7-15/h5,8,11-12,14,17H,3-4,6-7,9-10H2,1-2H3
InChIKeyDGFPESKPOCTJCR-UHFFFAOYSA-N
XLogP2.27
TPSA28.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(2-methoxyethyl)pyrrol-3-yl]-2-methylpropan-1-ol
CID 79097770
2-methyl-1-[1-(4-methylpentyl)pyrrol-3-yl]propan-1-ol
CID 83158832
1-[2-[3-(1-hydroxy-2-methylpropyl)pyrrol-1-yl]ethyl]pyridin-2-one
CID 82907186
2-methyl-1-[1-(2-methylpropyl)pyrrol-3-yl]propan-1-ol
CID 79097185
2-methyl-1-[1-[2-(2-methylimidazol-1-yl)ethyl]pyrrol-3-yl]propan-1-ol
CID 79096945
3-[3-(1-hydroxy-2-methylpropyl)pyrrol-1-yl]-N,N-dimethylpropanamide
CID 79097273
methyl 3-[3-(1-hydroxy-2-methylpropyl)pyrrol-1-yl]propanoate
CID 79097942
N-ethyl-1-[1-(2-piperidin-1-ylethyl)pyrrol-3-yl]butan-1-amine
CID 79108467
1-[1-(2-bromoprop-2-enyl)pyrrol-3-yl]-2-methylpropan-1-ol
CID 79097013
1-[1-(2-morpholin-4-ylethyl)pyrrol-3-yl]butan-1-ol
CID 79110104
3-bromo-1-(2-pyrrolidin-1-ylethyl)pyrrole
CID 58180048
2-methyl-1-[1-(2-pyridin-2-ylethyl)pyrrol-3-yl]propan-1-ol
CID 79097183

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol?
The IUPAC name of 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol (CID 79096939) is 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol.
What is the SMILES notation for 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol?
The canonical SMILES for 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol is CC(C)C(O)c1ccn(CCN2CCCC2)c1.
What is the InChIKey of 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol?
The InChIKey is DGFPESKPOCTJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-12(2)14(17)13-5-8-16(11-13)10-9-15-6-3-4-7-15/h5,8,11-12,14,17H,3-4,6-7,9-10H2,1-2H3.
What are the key properties of 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol?
2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol has a molecular weight of 236.36 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[1-(2-pyrrolidin-1-ylethyl)pyrrol-3-yl]propan-1-ol is sourced from PubChem (CID 79096939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).