(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid

C10H11N3O2 — CID 174758035

IUPAC(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid
SMILESCCc1c[nH]c2cc(NC(=O)O)ncc12
InChIInChI=1S/C10H11N3O2/c1-2-6-4-11-8-3-9(13-10(14)15)12-5-7(6)8/h3-5,11H,2H2,1H3,(H,12,13)(H,14,15)
InChIKeyBMFUBUNVAUBAPD-UHFFFAOYSA-N
MW205.22 g/mol
LogP2.22
Rot. Bonds2

About (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid

(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid (PubChem CID 174758035) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid.

Molecular Properties

Compound Name(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid
PubChem CID174758035
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid
SMILESCCc1c[nH]c2cc(NC(=O)O)ncc12
InChIInChI=1S/C10H11N3O2/c1-2-6-4-11-8-3-9(13-10(14)15)12-5-7(6)8/h3-5,11H,2H2,1H3,(H,12,13)(H,14,15)
InChIKeyBMFUBUNVAUBAPD-UHFFFAOYSA-N
XLogP2.22
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-ethyl-1H-pyrrolo[3,2-c]pyridine-6-carboxylate
CID 175290315
6-bromo-3-ethyl-1H-pyrrolo[3,2-c]pyridine;ethane
CID 144813636
5-ethyl-2-methyl-7H-pyrrolo[2,3-d]pyrimidine
CID 123585773
1H-pyrrolo[2,3-c]pyridin-5-ylcarbamic acid
CID 137499260
methyl 3-ethyl-1H-indole-6-carboxylate
CID 22627226
3-ethyl-1H-indole-5-carboxylic acid
CID 70338709
pyrido[3,4-b]pyrazin-7-ylcarbamic acid
CID 149253960
[3-(ethylamino)-1H-pyrazolo[4,3-c]pyridin-6-yl]urea
CID 123871133
3-ethyl-1H-indol-6-amine;N-methylformamide
CID 155742399
(5-methyl-1H-pyrazol-3-yl)carbamic acid
CID 23091960
3-ethyl-6-iodo-1H-indole
CID 135269455
2-phenyl-N-(1H-pyrrolo[2,3-c]pyridin-5-yl)acetamide
CID 168875352

Frequently Asked Questions

What is the IUPAC name of (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid?
The IUPAC name of (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid (CID 174758035) is (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid.
What is the SMILES notation for (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid?
The canonical SMILES for (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid is CCc1c[nH]c2cc(NC(=O)O)ncc12.
What is the InChIKey of (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid?
The InChIKey is BMFUBUNVAUBAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-2-6-4-11-8-3-9(13-10(14)15)12-5-7(6)8/h3-5,11H,2H2,1H3,(H,12,13)(H,14,15).
What are the key properties of (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid?
(3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid has a molecular weight of 205.22 g/mol, XLogP of 2.22, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-1H-pyrrolo[3,2-c]pyridin-6-yl)carbamic acid is sourced from PubChem (CID 174758035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).