N-methyl-3-(oxolan-2-yl)propan-1-amine

C8H17NO — CID 12700136

IUPACN-methyl-3-(oxolan-2-yl)propan-1-amine
SMILESCNCCCC1CCCO1
InChIInChI=1S/C8H17NO/c1-9-6-2-4-8-5-3-7-10-8/h8-9H,2-7H2,1H3
InChIKeySLKWAGFQOAXGGP-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.16
Rot. Bonds4

About N-methyl-3-(oxolan-2-yl)propan-1-amine

N-methyl-3-(oxolan-2-yl)propan-1-amine (PubChem CID 12700136) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-methyl-3-(oxolan-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(oxolan-2-yl)propan-1-amine
PubChem CID12700136
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-methyl-3-(oxolan-2-yl)propan-1-amine
SMILESCNCCCC1CCCO1
InChIInChI=1S/C8H17NO/c1-9-6-2-4-8-5-3-7-10-8/h8-9H,2-7H2,1H3
InChIKeySLKWAGFQOAXGGP-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.16
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

Methyl[2-(oxan-2-yl)ethyl]amine
CID 45791005
Methyl(2-(oxolan-2-yl)ethyl)amine hydrochloride
CID 75481481
Methyl[2-(oxolan-2-yl)ethyl]amine
CID 20773508
N-[2-[(2R)-oxolan-2-yl]ethyl]heptan-4-amine
CID 93468164
Tetrahydro-5-methyl-2-furanpropanamine
CID 55289661
1-(a-Tetrahydrofuryl)-2-ethylaminopropane
CID 60817983
1-Methylamino-1-(alpha-tetrahydrofuryl) propane
CID 129870720
3-(oxolan-2-yl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 65156707
3,3,3-trifluoro-N-[3-(oxolan-2-yl)propyl]propan-1-amine
CID 65163907
1,1,1-trifluoro-N-methyl-5-(oxolan-2-yl)pentan-3-amine
CID 65164288
6,6,6-trifluoro-N-methyl-1-(oxolan-2-yl)hexan-3-amine
CID 79953915
1,1-difluoro-N-methyl-4-(oxolan-2-yl)butan-2-amine
CID 103516729

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(oxolan-2-yl)propan-1-amine?
The IUPAC name of N-methyl-3-(oxolan-2-yl)propan-1-amine (CID 12700136) is N-methyl-3-(oxolan-2-yl)propan-1-amine.
What is the SMILES notation for N-methyl-3-(oxolan-2-yl)propan-1-amine?
The canonical SMILES for N-methyl-3-(oxolan-2-yl)propan-1-amine is CNCCCC1CCCO1.
What is the InChIKey of N-methyl-3-(oxolan-2-yl)propan-1-amine?
The InChIKey is SLKWAGFQOAXGGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-9-6-2-4-8-5-3-7-10-8/h8-9H,2-7H2,1H3.
What are the key properties of N-methyl-3-(oxolan-2-yl)propan-1-amine?
N-methyl-3-(oxolan-2-yl)propan-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(oxolan-2-yl)propan-1-amine is sourced from PubChem (CID 12700136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).