2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine

C10H17N — CID 79358778

IUPAC2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine
SMILESC#CCNC1C(C)(C)C1(C)C
InChIInChI=1S/C10H17N/c1-6-7-11-8-9(2,3)10(8,4)5/h1,8,11H,7H2,2-5H3
InChIKeyAWOFPYGIFSZOMD-UHFFFAOYSA-N
MW151.25 g/mol
LogP1.64
Rot. Bonds2

About 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine

2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine (PubChem CID 79358778) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine.

Molecular Properties

Compound Name2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine
PubChem CID79358778
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine
SMILESC#CCNC1C(C)(C)C1(C)C
InChIInChI=1S/C10H17N/c1-6-7-11-8-9(2,3)10(8,4)5/h1,8,11H,7H2,2-5H3
InChIKeyAWOFPYGIFSZOMD-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine?
The IUPAC name of 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine (CID 79358778) is 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine.
What is the SMILES notation for 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine?
The canonical SMILES for 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine is C#CCNC1C(C)(C)C1(C)C.
What is the InChIKey of 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine?
The InChIKey is AWOFPYGIFSZOMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-6-7-11-8-9(2,3)10(8,4)5/h1,8,11H,7H2,2-5H3.
What are the key properties of 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine?
2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine has a molecular weight of 151.25 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetramethyl-N-prop-2-ynylcyclopropan-1-amine is sourced from PubChem (CID 79358778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).