N-[2-(oxolan-2-yl)ethyl]propan-2-amine

C9H19NO — CID 61039101

IUPACN-[2-(oxolan-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCC1CCCO1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-5-9-4-3-7-11-9/h8-10H,3-7H2,1-2H3
InChIKeyRKGNRYFEYQFVTE-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.55
Rot. Bonds4

About N-[2-(oxolan-2-yl)ethyl]propan-2-amine

N-[2-(oxolan-2-yl)ethyl]propan-2-amine (PubChem CID 61039101) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-[2-(oxolan-2-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(oxolan-2-yl)ethyl]propan-2-amine
PubChem CID61039101
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-[2-(oxolan-2-yl)ethyl]propan-2-amine
SMILESCC(C)NCCC1CCCO1
InChIInChI=1S/C9H19NO/c1-8(2)10-6-5-9-4-3-7-11-9/h8-10H,3-7H2,1-2H3
InChIKeyRKGNRYFEYQFVTE-UHFFFAOYSA-N
XLogP1.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(oxolan-2-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(oxolan-2-yl)ethyl]propan-2-amine (CID 61039101) is N-[2-(oxolan-2-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(oxolan-2-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(oxolan-2-yl)ethyl]propan-2-amine is CC(C)NCCC1CCCO1.
What is the InChIKey of N-[2-(oxolan-2-yl)ethyl]propan-2-amine?
The InChIKey is RKGNRYFEYQFVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)10-6-5-9-4-3-7-11-9/h8-10H,3-7H2,1-2H3.
What are the key properties of N-[2-(oxolan-2-yl)ethyl]propan-2-amine?
N-[2-(oxolan-2-yl)ethyl]propan-2-amine has a molecular weight of 157.26 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(oxolan-2-yl)ethyl]propan-2-amine is sourced from PubChem (CID 61039101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).