2-N-propyl-1H-indole-2,3-diamine

C11H15N3 — CID 150814806

IUPAC2-N-propyl-1H-indole-2,3-diamine
SMILESCCCNc1[nH]c2ccccc2c1N
InChIInChI=1S/C11H15N3/c1-2-7-13-11-10(12)8-5-3-4-6-9(8)14-11/h3-6,13-14H,2,7,12H2,1H3
InChIKeyKIQMDULOKICGMM-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.57
Rot. Bonds3

About 2-N-propyl-1H-indole-2,3-diamine

2-N-propyl-1H-indole-2,3-diamine (PubChem CID 150814806) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-N-propyl-1H-indole-2,3-diamine.

Molecular Properties

Compound Name2-N-propyl-1H-indole-2,3-diamine
PubChem CID150814806
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2-N-propyl-1H-indole-2,3-diamine
SMILESCCCNc1[nH]c2ccccc2c1N
InChIInChI=1S/C11H15N3/c1-2-7-13-11-10(12)8-5-3-4-6-9(8)14-11/h3-6,13-14H,2,7,12H2,1H3
InChIKeyKIQMDULOKICGMM-UHFFFAOYSA-N
XLogP2.57
TPSA53.84 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

bis(9H-carbazole);propane
CID 90987002
3-(propylamino)-2H-isoquinolin-1-one
CID 60922442
bis(9H-carbazole);platinum(2+)
CID 175826437
1-N-propylphthalazine-1,4-diamine
CID 90689630
1-N-(2-methyl-1H-indol-3-yl)butane-1,3-diamine
CID 115199020
3-methyl-1-N-(2-methyl-1H-indol-3-yl)butane-1,3-diamine
CID 115200369
2-(2,2-dimethylpentylamino)-1H-indole-3-carbonitrile
CID 115146441
N-(2-chloroethyl)-2-methyl-1H-indol-3-amine
CID 115214600
3-ethyl-1H-indole-2-carbonitrile
CID 89048363
ethane;2-N-propylbenzene-1,2-diamine
CID 91196578
butane;2,3-dimethyl-1H-indole
CID 143059445
2-propan-2-yl-1H-indol-3-amine
CID 166774840

Frequently Asked Questions

What is the IUPAC name of 2-N-propyl-1H-indole-2,3-diamine?
The IUPAC name of 2-N-propyl-1H-indole-2,3-diamine (CID 150814806) is 2-N-propyl-1H-indole-2,3-diamine.
What is the SMILES notation for 2-N-propyl-1H-indole-2,3-diamine?
The canonical SMILES for 2-N-propyl-1H-indole-2,3-diamine is CCCNc1[nH]c2ccccc2c1N.
What is the InChIKey of 2-N-propyl-1H-indole-2,3-diamine?
The InChIKey is KIQMDULOKICGMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-2-7-13-11-10(12)8-5-3-4-6-9(8)14-11/h3-6,13-14H,2,7,12H2,1H3.
What are the key properties of 2-N-propyl-1H-indole-2,3-diamine?
2-N-propyl-1H-indole-2,3-diamine has a molecular weight of 189.26 g/mol, XLogP of 2.57, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-propyl-1H-indole-2,3-diamine is sourced from PubChem (CID 150814806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).