N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine

C9H24N2O — CID 162132556

IUPACN,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine
SMILESCNCC(C)C.COCN(C)C
InChIInChI=1S/C5H13N.C4H11NO/c2*1-5(2)4-6-3/h5-6H,4H2,1-3H3;4H2,1-3H3
InChIKeyZIVVYCBWGNHEGH-UHFFFAOYSA-N
MW176.30 g/mol
LogP1.01
Rot. Bonds4

About N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine

N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine (PubChem CID 162132556) has the molecular formula C9H24N2O and a molecular weight of 176.30 g/mol. Its IUPAC name is N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine.

Molecular Properties

Compound NameN,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine
PubChem CID162132556
Molecular FormulaC9H24N2O
Molecular Weight176.30 g/mol
Exact Mass176.19
IUPAC NameN,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine
SMILESCNCC(C)C.COCN(C)C
InChIInChI=1S/C5H13N.C4H11NO/c2*1-5(2)4-6-3/h5-6H,4H2,1-3H3;4H2,1-3H3
InChIKeyZIVVYCBWGNHEGH-UHFFFAOYSA-N
XLogP1.01
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 51.01
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

N,2-dimethylpropan-1-amine;methanamine
CID 144585140
2-N-(2-methoxyethyl)-1-N,2-N-dimethylpropane-1,2-diamine
CID 62447079
3-methoxy-1-N,2-N-dimethyl-2-N-(3-methylbutyl)propane-1,2-diamine
CID 103226184
3-methoxy-2-N-(1-methoxypropan-2-yl)-1-N,2-N-dimethylpropane-1,2-diamine
CID 103225975
2-N-(2-methoxyethyl)-1-N-methyl-2-N-(2-methylpropyl)propane-1,2-diamine
CID 62428889
N-(1-methoxypropan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
CID 62429833
N-(4-methoxybutan-2-yl)-N,N',2-trimethylpropane-1,3-diamine
CID 106915876
1-N,2-dimethyl-3-N,3-N-bis(2-methylpropyl)butane-1,3-diamine
CID 79409781
(2R)-N-methyl-2-phosphanylpropan-1-amine
CID 171624131
(2S)-1-N-methyl-2-N-(2-methylpropyl)propane-1,2-diamine
CID 58015292
3-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-ylpropane-1,2-diamine
CID 103225752
2-N-(2-methoxyethyl)-1-N-methyl-2-N-propan-2-ylpropane-1,2-diamine
CID 82952553

Frequently Asked Questions

What is the IUPAC name of N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine?
The IUPAC name of N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine (CID 162132556) is N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine.
What is the SMILES notation for N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine?
The canonical SMILES for N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine is CNCC(C)C.COCN(C)C.
What is the InChIKey of N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine?
The InChIKey is ZIVVYCBWGNHEGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N.C4H11NO/c2*1-5(2)4-6-3/h5-6H,4H2,1-3H3;4H2,1-3H3.
What are the key properties of N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine?
N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine has a molecular weight of 176.30 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethylpropan-1-amine;1-methoxy-N,N-dimethylmethanamine is sourced from PubChem (CID 162132556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).