N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine

C10H21NO — CID 65458090

IUPACN-[2-(cyclobutylmethoxy)ethyl]propan-2-amine
SMILESCC(C)NCCOCC1CCC1
InChIInChI=1S/C10H21NO/c1-9(2)11-6-7-12-8-10-4-3-5-10/h9-11H,3-8H2,1-2H3
InChIKeyNSZNTSQZTLLDJD-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds6

About N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine

N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine (PubChem CID 65458090) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(cyclobutylmethoxy)ethyl]propan-2-amine
PubChem CID65458090
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC NameN-[2-(cyclobutylmethoxy)ethyl]propan-2-amine
SMILESCC(C)NCCOCC1CCC1
InChIInChI=1S/C10H21NO/c1-9(2)11-6-7-12-8-10-4-3-5-10/h9-11H,3-8H2,1-2H3
InChIKeyNSZNTSQZTLLDJD-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 66602657
N-[2-(cyclohexylmethoxy)ethyl]-3-methylbutan-1-amine
CID 62582719
N-[2-(cyclopropylmethoxy)ethyl]-1-(oxolan-2-yl)ethanamine
CID 62599763
N-[3-(cyclopropylmethoxy)propyl]-3-(propan-2-ylamino)propanamide
CID 60852522
N-[2-(cyclopentylmethoxy)ethyl]-3-propan-2-yloxypropan-1-amine
CID 66323366
N-[2-(cyclopropylmethoxy)ethyl]-1-(furan-2-yl)ethanamine
CID 62598356
N-[2-(cyclopropylmethoxy)ethyl]-1-phenylethanamine
CID 115638914
N-(cyclopentylmethyl)-2-(cyclopropylmethoxy)ethanamine
CID 62599762
2-(cyclopentylmethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074903
6-(cyclopentylmethoxy)-N-(2-methylpropyl)hexan-1-amine
CID 66321215

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine?
The IUPAC name of N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine (CID 65458090) is N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine is CC(C)NCCOCC1CCC1.
What is the InChIKey of N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine?
The InChIKey is NSZNTSQZTLLDJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)11-6-7-12-8-10-4-3-5-10/h9-11H,3-8H2,1-2H3.
What are the key properties of N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine?
N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine has a molecular weight of 171.28 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclobutylmethoxy)ethyl]propan-2-amine is sourced from PubChem (CID 65458090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).