2-methoxy-N-propan-2-ylcyclopentan-1-amine

C9H19NO — CID 62088372

IUPAC2-methoxy-N-propan-2-ylcyclopentan-1-amine
SMILESCOC1CCCC1NC(C)C
InChIInChI=1S/C9H19NO/c1-7(2)10-8-5-4-6-9(8)11-3/h7-10H,4-6H2,1-3H3
InChIKeyHEQXYIUTSNYFRM-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.55
Rot. Bonds3

About 2-methoxy-N-propan-2-ylcyclopentan-1-amine

2-methoxy-N-propan-2-ylcyclopentan-1-amine (PubChem CID 62088372) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-methoxy-N-propan-2-ylcyclopentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-propan-2-ylcyclopentan-1-amine
PubChem CID62088372
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-methoxy-N-propan-2-ylcyclopentan-1-amine
SMILESCOC1CCCC1NC(C)C
InChIInChI=1S/C9H19NO/c1-7(2)10-8-5-4-6-9(8)11-3/h7-10H,4-6H2,1-3H3
InChIKeyHEQXYIUTSNYFRM-UHFFFAOYSA-N
XLogP1.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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 2-methoxy-N-propan-2-ylcyclopentan-1-amine?
The IUPAC name of 2-methoxy-N-propan-2-ylcyclopentan-1-amine (CID 62088372) is 2-methoxy-N-propan-2-ylcyclopentan-1-amine.
What is the SMILES notation for 2-methoxy-N-propan-2-ylcyclopentan-1-amine?
The canonical SMILES for 2-methoxy-N-propan-2-ylcyclopentan-1-amine is COC1CCCC1NC(C)C.
What is the InChIKey of 2-methoxy-N-propan-2-ylcyclopentan-1-amine?
The InChIKey is HEQXYIUTSNYFRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(2)10-8-5-4-6-9(8)11-3/h7-10H,4-6H2,1-3H3.
What are the key properties of 2-methoxy-N-propan-2-ylcyclopentan-1-amine?
2-methoxy-N-propan-2-ylcyclopentan-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-propan-2-ylcyclopentan-1-amine is sourced from PubChem (CID 62088372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).