(1R)-N-methanidyl-N-methyl-1-phenylethanamine

C10H14N- — CID 59297896

IUPAC(1R)-N-methanidyl-N-methyl-1-phenylethanamine
SMILES[CH2-]N(C)[C@H](C)c1ccccc1
InChIInChI=1S/C10H14N/c1-9(11(2)3)10-7-5-4-6-8-10/h4-9H,2H2,1,3H3/q-1/t9-/m1/s1
InChIKeyULAQMPHFVDJQLA-SECBINFHSA-N
MW148.23 g/mol
LogP2.47
Rot. Bonds2

About (1R)-N-methanidyl-N-methyl-1-phenylethanamine

(1R)-N-methanidyl-N-methyl-1-phenylethanamine (PubChem CID 59297896) has the molecular formula C10H14N- and a molecular weight of 148.23 g/mol. Its IUPAC name is (1R)-N-methanidyl-N-methyl-1-phenylethanamine.

Molecular Properties

Compound Name(1R)-N-methanidyl-N-methyl-1-phenylethanamine
PubChem CID59297896
Molecular FormulaC10H14N-
Molecular Weight148.23 g/mol
Exact Mass148.11
IUPAC Name(1R)-N-methanidyl-N-methyl-1-phenylethanamine
SMILES[CH2-]N(C)[C@H](C)c1ccccc1
InChIInChI=1S/C10H14N/c1-9(11(2)3)10-7-5-4-6-8-10/h4-9H,2H2,1,3H3/q-1/t9-/m1/s1
InChIKeyULAQMPHFVDJQLA-SECBINFHSA-N
XLogP2.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
(1S)-N,N-dimethyl-1-phenylethanamine;hydrochloride
CID 141121906
2-[methanidyl(1-phenylethyl)amino]ethanol
CID 123296934
(1R)-1-phenyl-N,N-bis[(1R)-1-phenylethyl]ethanamine;(1S)-1-phenyl-N,N-bis[(1S)-1-phenylethyl]ethanamine
CID 139197887
N-methanidyl-N-methyl-1-phenylethanamine;tungsten;yttrium
CID 58360887
methyl(1-phenylethyl)cyanamide
CID 117029364
methyl(1-phenylethyl)carbamic acid
CID 67062794
(1S)-N-benzyl-N-methyl-1-phenylethanamine
CID 122522292
N-methyl-1-phenyl-N-(trimethylsilylmethyl)ethanamine
CID 15113036
(1S)-N-[bis(2-methylpropyl)phosphanyl]-1-phenyl-N-[(1S)-1-phenylethyl]ethanamine
CID 72701790
(2R)-2-[methyl-[(1R)-1-phenylethyl]amino]-2-phenylethanol
CID 14738807
(1S)-N-methyl-1-phenyl-N-(trimethylsilylmethyl)ethanamine
CID 141001735

Frequently Asked Questions

What is the IUPAC name of (1R)-N-methanidyl-N-methyl-1-phenylethanamine?
The IUPAC name of (1R)-N-methanidyl-N-methyl-1-phenylethanamine (CID 59297896) is (1R)-N-methanidyl-N-methyl-1-phenylethanamine.
What is the SMILES notation for (1R)-N-methanidyl-N-methyl-1-phenylethanamine?
The canonical SMILES for (1R)-N-methanidyl-N-methyl-1-phenylethanamine is [CH2-]N(C)[C@H](C)c1ccccc1.
What is the InChIKey of (1R)-N-methanidyl-N-methyl-1-phenylethanamine?
The InChIKey is ULAQMPHFVDJQLA-SECBINFHSA-N. The full InChI is InChI=1S/C10H14N/c1-9(11(2)3)10-7-5-4-6-8-10/h4-9H,2H2,1,3H3/q-1/t9-/m1/s1.
What are the key properties of (1R)-N-methanidyl-N-methyl-1-phenylethanamine?
(1R)-N-methanidyl-N-methyl-1-phenylethanamine has a molecular weight of 148.23 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methanidyl-N-methyl-1-phenylethanamine is sourced from PubChem (CID 59297896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).