N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine

C14H21N3O — CID 171724883

IUPACN-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine
SMILESCOc1cc2c(CCN(C)C(C)C)c[nH]c2cn1
InChIInChI=1S/C14H21N3O/c1-10(2)17(3)6-5-11-8-15-13-9-16-14(18-4)7-12(11)13/h7-10,15H,5-6H2,1-4H3
InChIKeyRCVSKGXVYJVCAT-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.45
Rot. Bonds5

About N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine

N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine (PubChem CID 171724883) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine
PubChem CID171724883
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC NameN-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine
SMILESCOc1cc2c(CCN(C)C(C)C)c[nH]c2cn1
InChIInChI=1S/C14H21N3O/c1-10(2)17(3)6-5-11-8-15-13-9-16-14(18-4)7-12(11)13/h7-10,15H,5-6H2,1-4H3
InChIKeyRCVSKGXVYJVCAT-UHFFFAOYSA-N
XLogP2.45
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine
CID 167469236
[3-[2-[methyl(propan-2-yl)amino]ethyl]-1H-indol-5-yl] propanoate
CID 169222529
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
CID 24802109
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrate;hydrochloride
CID 71311787
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
CID 23815452
4-[[3-[2-[methyl(propan-2-yl)amino]ethyl]-1H-indol-5-yl]oxy]-4-oxobutanoic acid
CID 169222132
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-N-methylbutan-2-amine
CID 166158013
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 74405227
2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine
CID 139579759
3-iodo-6-methoxy-1H-pyrrolo[3,2-c]pyridine
CID 53412708
[1-[2-[2-(4-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl-methylamino]propyl]-3-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolo[2,3-c]pyridin-4-yl] acetate
CID 170100530
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine
CID 67231451

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine?
The IUPAC name of N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine (CID 171724883) is N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine is COc1cc2c(CCN(C)C(C)C)c[nH]c2cn1.
What is the InChIKey of N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine?
The InChIKey is RCVSKGXVYJVCAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c1-10(2)17(3)6-5-11-8-15-13-9-16-14(18-4)7-12(11)13/h7-10,15H,5-6H2,1-4H3.
What are the key properties of N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine?
N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine has a molecular weight of 247.34 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine is sourced from PubChem (CID 171724883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).