2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine

C19H30N2 — CID 62512720

IUPAC2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCN(c2cccc3c2CCCC3)C1
InChIInChI=1S/C19H30N2/c1-19(2,3)20-13-15-11-12-21(14-15)18-10-6-8-16-7-4-5-9-17(16)18/h6,8,10,15,20H,4-5,7,9,11-14H2,1-3H3
InChIKeyXTCKJGVNUVJNKK-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.78
Rot. Bonds3

About 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine

2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine (PubChem CID 62512720) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine
PubChem CID62512720
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCN(c2cccc3c2CCCC3)C1
InChIInChI=1S/C19H30N2/c1-19(2,3)20-13-15-11-12-21(14-15)18-10-6-8-16-7-4-5-9-17(16)18/h6,8,10,15,20H,4-5,7,9,11-14H2,1-3H3
InChIKeyXTCKJGVNUVJNKK-UHFFFAOYSA-N
XLogP3.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine (CID 62512720) is 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine is CC(C)(C)NCC1CCN(c2cccc3c2CCCC3)C1.
What is the InChIKey of 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
The InChIKey is XTCKJGVNUVJNKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-19(2,3)20-13-15-11-12-21(14-15)18-10-6-8-16-7-4-5-9-17(16)18/h6,8,10,15,20H,4-5,7,9,11-14H2,1-3H3.
What are the key properties of 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine?
2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine has a molecular weight of 286.46 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(5,6,7,8-tetrahydronaphthalen-1-yl)pyrrolidin-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 62512720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).