N-methylmethanamine;3-phenylpropan-1-ol

C11H19NO — CID 174893841

IUPACN-methylmethanamine;3-phenylpropan-1-ol
SMILESCNC.OCCCc1ccccc1
InChIInChI=1S/C9H12O.C2H7N/c10-8-4-7-9-5-2-1-3-6-9;1-3-2/h1-3,5-6,10H,4,7-8H2;3H,1-2H3
InChIKeyRRAKKXOBNIMUKL-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.45
Rot. Bonds3

About N-methylmethanamine;3-phenylpropan-1-ol

N-methylmethanamine;3-phenylpropan-1-ol (PubChem CID 174893841) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is N-methylmethanamine;3-phenylpropan-1-ol.

Molecular Properties

Compound NameN-methylmethanamine;3-phenylpropan-1-ol
PubChem CID174893841
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC NameN-methylmethanamine;3-phenylpropan-1-ol
SMILESCNC.OCCCc1ccccc1
InChIInChI=1S/C9H12O.C2H7N/c10-8-4-7-9-5-2-1-3-6-9;1-3-2/h1-3,5-6,10H,4,7-8H2;3H,1-2H3
InChIKeyRRAKKXOBNIMUKL-UHFFFAOYSA-N
XLogP1.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;3-phenylpropan-1-ol?
The IUPAC name of N-methylmethanamine;3-phenylpropan-1-ol (CID 174893841) is N-methylmethanamine;3-phenylpropan-1-ol.
What is the SMILES notation for N-methylmethanamine;3-phenylpropan-1-ol?
The canonical SMILES for N-methylmethanamine;3-phenylpropan-1-ol is CNC.OCCCc1ccccc1.
What is the InChIKey of N-methylmethanamine;3-phenylpropan-1-ol?
The InChIKey is RRAKKXOBNIMUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O.C2H7N/c10-8-4-7-9-5-2-1-3-6-9;1-3-2/h1-3,5-6,10H,4,7-8H2;3H,1-2H3.
What are the key properties of N-methylmethanamine;3-phenylpropan-1-ol?
N-methylmethanamine;3-phenylpropan-1-ol has a molecular weight of 181.28 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;3-phenylpropan-1-ol is sourced from PubChem (CID 174893841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).