N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine

C18H27N3 — CID 162388936

IUPACN,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine
SMILESCN(C)C(C)(C)Cn1ccc2cc(N3CCCC3)ccc21
InChIInChI=1S/C18H27N3/c1-18(2,19(3)4)14-21-12-9-15-13-16(7-8-17(15)21)20-10-5-6-11-20/h7-9,12-13H,5-6,10-11,14H2,1-4H3
InChIKeyRKDMZHCAXPVFGJ-UHFFFAOYSA-N
MW285.44 g/mol
LogP3.58
Rot. Bonds4

About N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine

N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine (PubChem CID 162388936) has the molecular formula C18H27N3 and a molecular weight of 285.44 g/mol. Its IUPAC name is N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine.

Molecular Properties

Compound NameN,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine
PubChem CID162388936
Molecular FormulaC18H27N3
Molecular Weight285.44 g/mol
Exact Mass285.22
IUPAC NameN,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine
SMILESCN(C)C(C)(C)Cn1ccc2cc(N3CCCC3)ccc21
InChIInChI=1S/C18H27N3/c1-18(2,19(3)4)14-21-12-9-15-13-16(7-8-17(15)21)20-10-5-6-11-20/h7-9,12-13H,5-6,10-11,14H2,1-4H3
InChIKeyRKDMZHCAXPVFGJ-UHFFFAOYSA-N
XLogP3.58
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.44
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine?
The IUPAC name of N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine (CID 162388936) is N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine.
What is the SMILES notation for N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine?
The canonical SMILES for N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine is CN(C)C(C)(C)Cn1ccc2cc(N3CCCC3)ccc21.
What is the InChIKey of N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine?
The InChIKey is RKDMZHCAXPVFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3/c1-18(2,19(3)4)14-21-12-9-15-13-16(7-8-17(15)21)20-10-5-6-11-20/h7-9,12-13H,5-6,10-11,14H2,1-4H3.
What are the key properties of N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine?
N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine has a molecular weight of 285.44 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2-trimethyl-1-(5-pyrrolidin-1-ylindol-1-yl)propan-2-amine is sourced from PubChem (CID 162388936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).