1-(1-adamantylmethyl)pyrrolidin-3-amine

C15H26N2 — CID 55029770

IUPAC1-(1-adamantylmethyl)pyrrolidin-3-amine
SMILESNC1CCN(CC23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C15H26N2/c16-14-1-2-17(9-14)10-15-6-11-3-12(7-15)5-13(4-11)8-15/h11-14H,1-10,16H2
InChIKeyUJDRAZLNZOQHNJ-UHFFFAOYSA-N
MW234.39 g/mol
LogP2.24
Rot. Bonds2

About 1-(1-adamantylmethyl)pyrrolidin-3-amine

1-(1-adamantylmethyl)pyrrolidin-3-amine (PubChem CID 55029770) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 1-(1-adamantylmethyl)pyrrolidin-3-amine.

Molecular Properties

Compound Name1-(1-adamantylmethyl)pyrrolidin-3-amine
PubChem CID55029770
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name1-(1-adamantylmethyl)pyrrolidin-3-amine
SMILESNC1CCN(CC23CC4CC(CC(C4)C2)C3)C1
InChIInChI=1S/C15H26N2/c16-14-1-2-17(9-14)10-15-6-11-3-12(7-15)5-13(4-11)8-15/h11-14H,1-10,16H2
InChIKeyUJDRAZLNZOQHNJ-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantylmethyl)pyrrolidin-3-amine?
The IUPAC name of 1-(1-adamantylmethyl)pyrrolidin-3-amine (CID 55029770) is 1-(1-adamantylmethyl)pyrrolidin-3-amine.
What is the SMILES notation for 1-(1-adamantylmethyl)pyrrolidin-3-amine?
The canonical SMILES for 1-(1-adamantylmethyl)pyrrolidin-3-amine is NC1CCN(CC23CC4CC(CC(C4)C2)C3)C1.
What is the InChIKey of 1-(1-adamantylmethyl)pyrrolidin-3-amine?
The InChIKey is UJDRAZLNZOQHNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c16-14-1-2-17(9-14)10-15-6-11-3-12(7-15)5-13(4-11)8-15/h11-14H,1-10,16H2.
What are the key properties of 1-(1-adamantylmethyl)pyrrolidin-3-amine?
1-(1-adamantylmethyl)pyrrolidin-3-amine has a molecular weight of 234.39 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantylmethyl)pyrrolidin-3-amine is sourced from PubChem (CID 55029770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).