(2R)-2-amino-2-methyl-3-phenylpropanimidamide

C10H15N3 — CID 70333912

IUPAC(2R)-2-amino-2-methyl-3-phenylpropanimidamide
SMILES[H]/N=C(\N)[C@](C)(N)Cc1ccccc1
InChIInChI=1S/C10H15N3/c1-10(13,9(11)12)7-8-5-3-2-4-6-8/h2-6H,7,13H2,1H3,(H3,11,12)/t10-/m1/s1
InChIKeyJKOKFGPIWQSBHF-SNVBAGLBSA-N
MW177.25 g/mol
LogP0.88
Rot. Bonds3

About (2R)-2-amino-2-methyl-3-phenylpropanimidamide

(2R)-2-amino-2-methyl-3-phenylpropanimidamide (PubChem CID 70333912) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is (2R)-2-amino-2-methyl-3-phenylpropanimidamide.

Molecular Properties

Compound Name(2R)-2-amino-2-methyl-3-phenylpropanimidamide
PubChem CID70333912
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name(2R)-2-amino-2-methyl-3-phenylpropanimidamide
SMILES[H]/N=C(\N)[C@](C)(N)Cc1ccccc1
InChIInChI=1S/C10H15N3/c1-10(13,9(11)12)7-8-5-3-2-4-6-8/h2-6H,7,13H2,1H3,(H3,11,12)/t10-/m1/s1
InChIKeyJKOKFGPIWQSBHF-SNVBAGLBSA-N
XLogP0.88
TPSA75.89 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2,2-dibenzylpropanediimidamide
CID 68501472
2,3-diamino-2-benzyl-3-iminopropanoic acid;hydrochloride
CID 140515646
(2R)-2-amino-2-methyl-3-phenylpropanoic acid
CID 7023409
(2R)-2-amino-2,4,4-trimethyl-1-phenylpentan-3-one
CID 177194439
2-amino-3-(4-benzylsulfanylphenyl)-2-methylpropanamide
CID 151945338
1-(3-amino-3-imino-2,2-dimethylpropyl)-3-benzylurea
CID 107654653
2,2-dimethylpropylbenzene;methanol
CID 157125736
N-[(2R)-2,3-diamino-2-benzyl-3-iminopropanoyl]dodecanamide
CID 22875389
2-phenylethanimidamide
CID 27787
(2S)-4-chloro-2-methyl-1-phenylpent-4-en-2-amine
CID 142543492
2-methyl-1-phenylpropan-2-amine;sulfuric acid
CID 174984746
(2R)-2-hydroxy-2-methyl-3-phenylpropanamide
CID 11389739

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-methyl-3-phenylpropanimidamide?
The IUPAC name of (2R)-2-amino-2-methyl-3-phenylpropanimidamide (CID 70333912) is (2R)-2-amino-2-methyl-3-phenylpropanimidamide.
What is the SMILES notation for (2R)-2-amino-2-methyl-3-phenylpropanimidamide?
The canonical SMILES for (2R)-2-amino-2-methyl-3-phenylpropanimidamide is [H]/N=C(\N)[C@](C)(N)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-2-methyl-3-phenylpropanimidamide?
The InChIKey is JKOKFGPIWQSBHF-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H15N3/c1-10(13,9(11)12)7-8-5-3-2-4-6-8/h2-6H,7,13H2,1H3,(H3,11,12)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-2-methyl-3-phenylpropanimidamide?
(2R)-2-amino-2-methyl-3-phenylpropanimidamide has a molecular weight of 177.25 g/mol, XLogP of 0.88, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-methyl-3-phenylpropanimidamide is sourced from PubChem (CID 70333912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).