N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine

C19H23N3 — CID 67761512

IUPACN-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine
SMILESCCCCn1cc(CCNc2ccncc2)c2ccccc21
InChIInChI=1S/C19H23N3/c1-2-3-14-22-15-16(18-6-4-5-7-19(18)22)8-13-21-17-9-11-20-12-10-17/h4-7,9-12,15H,2-3,8,13-14H2,1H3,(H,20,21)
InChIKeyCWVUFXZPSYSMNF-UHFFFAOYSA-N
MW293.41 g/mol
LogP4.49
Rot. Bonds7

About N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine

N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine (PubChem CID 67761512) has the molecular formula C19H23N3 and a molecular weight of 293.41 g/mol. Its IUPAC name is N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine
PubChem CID67761512
Molecular FormulaC19H23N3
Molecular Weight293.41 g/mol
Exact Mass293.19
IUPAC NameN-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine
SMILESCCCCn1cc(CCNc2ccncc2)c2ccccc21
InChIInChI=1S/C19H23N3/c1-2-3-14-22-15-16(18-6-4-5-7-19(18)22)8-13-21-17-9-11-20-12-10-17/h4-7,9-12,15H,2-3,8,13-14H2,1H3,(H,20,21)
InChIKeyCWVUFXZPSYSMNF-UHFFFAOYSA-N
XLogP4.49
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine?
The IUPAC name of N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine (CID 67761512) is N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine.
What is the SMILES notation for N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine?
The canonical SMILES for N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine is CCCCn1cc(CCNc2ccncc2)c2ccccc21.
What is the InChIKey of N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine?
The InChIKey is CWVUFXZPSYSMNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3/c1-2-3-14-22-15-16(18-6-4-5-7-19(18)22)8-13-21-17-9-11-20-12-10-17/h4-7,9-12,15H,2-3,8,13-14H2,1H3,(H,20,21).
What are the key properties of N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine?
N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine has a molecular weight of 293.41 g/mol, XLogP of 4.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-butylindol-3-yl)ethyl]pyridin-4-amine is sourced from PubChem (CID 67761512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).