(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone

C14H17N3O — CID 155511215

IUPAC(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone
SMILESNc1[nH]c2ccccc2c1C(=O)N1CCCCC1
InChIInChI=1S/C14H17N3O/c15-13-12(10-6-2-3-7-11(10)16-13)14(18)17-8-4-1-5-9-17/h2-3,6-7,16H,1,4-5,8-9,15H2
InChIKeyNWMUUIBDKDIAJT-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.38
Rot. Bonds1

About (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone

(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone (PubChem CID 155511215) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone
PubChem CID155511215
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone
SMILESNc1[nH]c2ccccc2c1C(=O)N1CCCCC1
InChIInChI=1S/C14H17N3O/c15-13-12(10-6-2-3-7-11(10)16-13)14(18)17-8-4-1-5-9-17/h2-3,6-7,16H,1,4-5,8-9,15H2
InChIKeyNWMUUIBDKDIAJT-UHFFFAOYSA-N
XLogP2.38
TPSA62.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone?
The IUPAC name of (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone (CID 155511215) is (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone is Nc1[nH]c2ccccc2c1C(=O)N1CCCCC1.
What is the InChIKey of (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone?
The InChIKey is NWMUUIBDKDIAJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c15-13-12(10-6-2-3-7-11(10)16-13)14(18)17-8-4-1-5-9-17/h2-3,6-7,16H,1,4-5,8-9,15H2.
What are the key properties of (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone?
(2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone has a molecular weight of 243.31 g/mol, XLogP of 2.38, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1H-indol-3-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 155511215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).