cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine

C7H15NO2 — CID 163636034

IUPACcis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine
SMILESCOCO[C@H]1CC[C@@H](N)C1
InChIInChI=1S/C7H15NO2/c1-9-5-10-7-3-2-6(8)4-7/h6-7H,2-5,8H2,1H3/t6-,7+/m1/s1
InChIKeyIAECXOBBCFULOE-RQJHMYQMSA-N
MW145.20 g/mol
LogP0.49
Rot. Bonds3

About cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine

cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine (PubChem CID 163636034) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine.

Molecular Properties

Compound Namecis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine
PubChem CID163636034
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Namecis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine
SMILESCOCO[C@H]1CC[C@@H](N)C1
InChIInChI=1S/C7H15NO2/c1-9-5-10-7-3-2-6(8)4-7/h6-7H,2-5,8H2,1H3/t6-,7+/m1/s1
InChIKeyIAECXOBBCFULOE-RQJHMYQMSA-N
XLogP0.49
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-[2-(2-methoxyethoxy)ethoxy]cyclopentan-1-amine
CID 79466003
3-(methoxymethoxy)cyclopentan-1-ol
CID 91618356
3-(cyclopropylmethoxy)cyclopentan-1-amine
CID 79458422
trans-(1R,3R)-3-methoxycyclopentan-1-amine;hydrochloride
CID 118523425
3-(2-ethoxyethoxy)cyclopentan-1-amine
CID 79465467
3-hexoxycyclopentan-1-amine
CID 79464533
trans-(1R,3R)-3-(2-methoxyethoxy)cyclohexan-1-amine
CID 156885950
3-(methoxymethoxy)cyclopentane-1-carboxylic acid
CID 19804660
ethyl 2-(3-aminocyclopentyl)oxyacetate
CID 106940565
2-(3-aminocyclopentyl)oxy-N,N-dimethylacetamide
CID 79465990
3-(3-aminocyclopentyl)oxypropan-1-ol
CID 106938667
3-(oxan-4-ylmethoxy)cyclopentan-1-amine
CID 79458329

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine?
The IUPAC name of cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine (CID 163636034) is cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine.
What is the SMILES notation for cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine?
The canonical SMILES for cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine is COCO[C@H]1CC[C@@H](N)C1.
What is the InChIKey of cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine?
The InChIKey is IAECXOBBCFULOE-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H15NO2/c1-9-5-10-7-3-2-6(8)4-7/h6-7H,2-5,8H2,1H3/t6-,7+/m1/s1.
What are the key properties of cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine?
cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine has a molecular weight of 145.20 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-(methoxymethoxy)cyclopentan-1-amine is sourced from PubChem (CID 163636034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).