N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine

C10H22N2 — CID 62261665

IUPACN,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine
SMILESCNCC(C)(C)CN1CCCC1
InChIInChI=1S/C10H22N2/c1-10(2,8-11-3)9-12-6-4-5-7-12/h11H,4-9H2,1-3H3
InChIKeyRREOLRQPNVHSFE-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.33
Rot. Bonds4

About N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine

N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine (PubChem CID 62261665) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine.

Molecular Properties

Compound NameN,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine
PubChem CID62261665
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine
SMILESCNCC(C)(C)CN1CCCC1
InChIInChI=1S/C10H22N2/c1-10(2,8-11-3)9-12-6-4-5-7-12/h11H,4-9H2,1-3H3
InChIKeyRREOLRQPNVHSFE-UHFFFAOYSA-N
XLogP1.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine?
The IUPAC name of N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine (CID 62261665) is N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine.
What is the SMILES notation for N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine?
The canonical SMILES for N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine is CNCC(C)(C)CN1CCCC1.
What is the InChIKey of N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine?
The InChIKey is RREOLRQPNVHSFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2,8-11-3)9-12-6-4-5-7-12/h11H,4-9H2,1-3H3.
What are the key properties of N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine?
N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine has a molecular weight of 170.30 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-pyrrolidin-1-ylpropan-1-amine is sourced from PubChem (CID 62261665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).