N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine

C9H17NO — CID 58394578

IUPACN-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine
SMILESC[C@@H]1CC[C@@H](NC2COC2)C1
InChIInChI=1S/C9H17NO/c1-7-2-3-8(4-7)10-9-5-11-6-9/h7-10H,2-6H2,1H3/t7-,8-/m1/s1
InChIKeyCPFJAHZBTAZRPK-HTQZYQBOSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds2

About N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine

N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine (PubChem CID 58394578) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine.

Molecular Properties

Compound NameN-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine
PubChem CID58394578
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine
SMILESC[C@@H]1CC[C@@H](NC2COC2)C1
InChIInChI=1S/C9H17NO/c1-7-2-3-8(4-7)10-9-5-11-6-9/h7-10H,2-6H2,1H3/t7-,8-/m1/s1
InChIKeyCPFJAHZBTAZRPK-HTQZYQBOSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine?
The IUPAC name of N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine (CID 58394578) is N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine.
What is the SMILES notation for N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine?
The canonical SMILES for N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine is C[C@@H]1CC[C@@H](NC2COC2)C1.
What is the InChIKey of N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine?
The InChIKey is CPFJAHZBTAZRPK-HTQZYQBOSA-N. The full InChI is InChI=1S/C9H17NO/c1-7-2-3-8(4-7)10-9-5-11-6-9/h7-10H,2-6H2,1H3/t7-,8-/m1/s1.
What are the key properties of N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine?
N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine has a molecular weight of 155.24 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3R)-3-methylcyclopentyl]oxetan-3-amine is sourced from PubChem (CID 58394578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).