N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine

C13H19N3 — CID 167469236

IUPACN-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine
SMILESCC(C)N(C)CCc1c[nH]c2ccncc12
InChIInChI=1S/C13H19N3/c1-10(2)16(3)7-5-11-8-15-13-4-6-14-9-12(11)13/h4,6,8-10,15H,5,7H2,1-3H3
InChIKeyGRWOUXPFQHTHQH-UHFFFAOYSA-N
MW217.32 g/mol
LogP2.45
Rot. Bonds4

About N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine

N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine (PubChem CID 167469236) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine
PubChem CID167469236
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC NameN-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine
SMILESCC(C)N(C)CCc1c[nH]c2ccncc12
InChIInChI=1S/C13H19N3/c1-10(2)16(3)7-5-11-8-15-13-4-6-14-9-12(11)13/h4,6,8-10,15H,5,7H2,1-3H3
InChIKeyGRWOUXPFQHTHQH-UHFFFAOYSA-N
XLogP2.45
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(5-methoxy-1H-pyrrolo[2,3-c]pyridin-3-yl)ethyl]-N-methylpropan-2-amine
CID 171724883
[3-[2-[methyl(propan-2-yl)amino]ethyl]-1H-indol-5-yl] propanoate
CID 169222529
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
tert-butyl (2S)-2-amino-3-(1H-pyrrolo[3,2-c]pyridin-3-yl)propanoate
CID 171338077
3-[2-(dimethylamino)ethyl]-1H-pyrrolo[2,3-c]pyridin-4-ol
CID 163393165
ethane;3-methyl-1H-pyrrolo[3,2-c]pyridine
CID 143713533
N-[2-(5-methyl-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine
CID 23815452
2-(1H-indol-3-yl)-N,N-dimethoxyethanamine
CID 87617375
2-(1H-pyrrolo[3,2-c]pyridin-3-yl)propanenitrile
CID 82412113
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
CID 24802109
N-[2-(1H-indol-3-yl)ethyl]-N-methyl-4-pyridin-4-ylbenzamide
CID 44587808

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine?
The IUPAC name of N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine (CID 167469236) is N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine is CC(C)N(C)CCc1c[nH]c2ccncc12.
What is the InChIKey of N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine?
The InChIKey is GRWOUXPFQHTHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-10(2)16(3)7-5-11-8-15-13-4-6-14-9-12(11)13/h4,6,8-10,15H,5,7H2,1-3H3.
What are the key properties of N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine?
N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine has a molecular weight of 217.32 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(1H-pyrrolo[3,2-c]pyridin-3-yl)ethyl]propan-2-amine is sourced from PubChem (CID 167469236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).