N-methyl-3-propan-2-yloxypropan-1-amine

C7H17NO — CID 19842664

IUPACN-methyl-3-propan-2-yloxypropan-1-amine
SMILESCNCCCOC(C)C
InChIInChI=1S/C7H17NO/c1-7(2)9-6-4-5-8-3/h7-8H,4-6H2,1-3H3
InChIKeyLFKFQHDZGFHGKP-UHFFFAOYSA-N
MW131.22 g/mol
LogP1.02
Rot. Bonds5

About N-methyl-3-propan-2-yloxypropan-1-amine

N-methyl-3-propan-2-yloxypropan-1-amine (PubChem CID 19842664) has the molecular formula C7H17NO and a molecular weight of 131.22 g/mol. Its IUPAC name is N-methyl-3-propan-2-yloxypropan-1-amine.

Molecular Properties

Compound NameN-methyl-3-propan-2-yloxypropan-1-amine
PubChem CID19842664
Molecular FormulaC7H17NO
Molecular Weight131.22 g/mol
Exact Mass131.13
IUPAC NameN-methyl-3-propan-2-yloxypropan-1-amine
SMILESCNCCCOC(C)C
InChIInChI=1S/C7H17NO/c1-7(2)9-6-4-5-8-3/h7-8H,4-6H2,1-3H3
InChIKeyLFKFQHDZGFHGKP-UHFFFAOYSA-N
XLogP1.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.22
LogP ≤ 51.02
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

N-methyl-N'-[2-(2-propan-2-yloxyethylamino)ethyl]propane-1,3-diamine
CID 149204249
N-[4-(methylamino)butyl]-4-propan-2-yloxybutanamide
CID 162749933
1,6-di(propan-2-yloxy)hexane
CID 10899702
1-methylpiperidine-4-carbaldehyde;N-methyl-3-propan-2-yloxypropan-1-amine
CID 143843368
1-propan-2-yloxybutane;zirconium
CID 174617524
methane;1-propan-2-yloxybutane
CID 158518476
3-methyl-N-(3-propan-2-yloxypropyl)butan-1-amine
CID 28726639
N-(3-propan-2-yloxypropyl)pentan-3-amine
CID 28727128
1,3-di(propan-2-yloxy)propane;methane;2-(2-propan-2-yloxyethoxy)propane
CID 157339053
2-(3-propan-2-yloxypropylamino)acetonitrile
CID 94826859
N'-methyl-N'-propan-2-yl-N-(3-propan-2-yloxypropyl)propane-1,3-diamine
CID 176860876
(2S)-2-chloro-N-(3-propan-2-yloxypropyl)propanamide
CID 92660589

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-propan-2-yloxypropan-1-amine?
The IUPAC name of N-methyl-3-propan-2-yloxypropan-1-amine (CID 19842664) is N-methyl-3-propan-2-yloxypropan-1-amine.
What is the SMILES notation for N-methyl-3-propan-2-yloxypropan-1-amine?
The canonical SMILES for N-methyl-3-propan-2-yloxypropan-1-amine is CNCCCOC(C)C.
What is the InChIKey of N-methyl-3-propan-2-yloxypropan-1-amine?
The InChIKey is LFKFQHDZGFHGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO/c1-7(2)9-6-4-5-8-3/h7-8H,4-6H2,1-3H3.
What are the key properties of N-methyl-3-propan-2-yloxypropan-1-amine?
N-methyl-3-propan-2-yloxypropan-1-amine has a molecular weight of 131.22 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-propan-2-yloxypropan-1-amine is sourced from PubChem (CID 19842664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).