N-methoxypropan-2-amine

C4H11NO — CID 12651820

IUPACN-methoxypropan-2-amine
SMILESCONC(C)C
InChIInChI=1S/C4H11NO/c1-4(2)5-6-3/h4-5H,1-3H3
InChIKeySTCMDMFTMKSBSV-UHFFFAOYSA-N
MW89.14 g/mol
LogP0.55
Rot. Bonds2

About N-methoxypropan-2-amine

N-methoxypropan-2-amine (PubChem CID 12651820) has the molecular formula C4H11NO and a molecular weight of 89.14 g/mol. Its IUPAC name is N-methoxypropan-2-amine.

Molecular Properties

Compound NameN-methoxypropan-2-amine
PubChem CID12651820
Molecular FormulaC4H11NO
Molecular Weight89.14 g/mol
Exact Mass89.08
IUPAC NameN-methoxypropan-2-amine
SMILESCONC(C)C
InChIInChI=1S/C4H11NO/c1-4(2)5-6-3/h4-5H,1-3H3
InChIKeySTCMDMFTMKSBSV-UHFFFAOYSA-N
XLogP0.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.14
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Isopropylhydroxylamine
CID 78763
Ethoxy(propan-2-yl)amine
CID 14849020
N-methoxycyclobutanamine hydrochloride
CID 139026574
(Butan-2-yl)(methoxy)amine hydrochloride
CID 71756556
Methoxy(propan-2-yl)amine hydrochloride
CID 71756557
Ethoxy(propan-2-yl)amine hydrochloride
CID 122163408
1-Methylpropylhydroxyl amine
CID 3018801
1-Propanamine, N-methoxy-
CID 11815284
Butyl(methoxy)amine
CID 12651819
N-methoxy-2-methylpropan-1-amine
CID 17885866
N-ethoxypropan-1-amine
CID 18936580
N-(pentan-3-yl)hydroxylamine
CID 19073513

Frequently Asked Questions

What is the IUPAC name of N-methoxypropan-2-amine?
The IUPAC name of N-methoxypropan-2-amine (CID 12651820) is N-methoxypropan-2-amine.
What is the SMILES notation for N-methoxypropan-2-amine?
The canonical SMILES for N-methoxypropan-2-amine is CONC(C)C.
What is the InChIKey of N-methoxypropan-2-amine?
The InChIKey is STCMDMFTMKSBSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO/c1-4(2)5-6-3/h4-5H,1-3H3.
What are the key properties of N-methoxypropan-2-amine?
N-methoxypropan-2-amine has a molecular weight of 89.14 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxypropan-2-amine is sourced from PubChem (CID 12651820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).