4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine

C14H23N3 — CID 124600300

IUPAC4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine
SMILESC[C@H](Cc1ccccc1)NN1CCN(C)CC1
InChIInChI=1S/C14H23N3/c1-13(12-14-6-4-3-5-7-14)15-17-10-8-16(2)9-11-17/h3-7,13,15H,8-12H2,1-2H3/t13-/m1/s1
InChIKeyAQSVTARLKMNPIF-CYBMUJFWSA-N
MW233.36 g/mol
LogP1.37
Rot. Bonds4

About 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine

4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine (PubChem CID 124600300) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine.

Molecular Properties

Compound Name4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine
PubChem CID124600300
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine
SMILESC[C@H](Cc1ccccc1)NN1CCN(C)CC1
InChIInChI=1S/C14H23N3/c1-13(12-14-6-4-3-5-7-14)15-17-10-8-16(2)9-11-17/h3-7,13,15H,8-12H2,1-2H3/t13-/m1/s1
InChIKeyAQSVTARLKMNPIF-CYBMUJFWSA-N
XLogP1.37
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-phenylpropan-2-yl)azepan-1-amine;hydrochloride
CID 11971660
2-N-(4-methylpiperazin-1-yl)-3-phenylpropane-1,2-diamine
CID 83011355
4-methyl-N-[(2S)-1-[3-(trifluoromethyl)phenyl]propan-2-yl]piperazin-1-amine
CID 7443492
4-methyl-N-(4-methylpentan-2-yl)piperazin-1-amine
CID 83010481
2-amino-N-(4-methylpiperazin-1-yl)-3-phenylpropanamide
CID 83015503
1-(4-methylpiperazin-1-yl)-2-phenylethanol
CID 173220641
4-[(3S)-3-[(4-methylpiperazin-1-yl)amino]butyl]phenol
CID 7445985
N-methyl-1-phenylpropan-2-amine
CID 118309477
2-N-(4-methylpiperazin-1-yl)-4-phenylpentane-1,2-diamine
CID 83010931
1-(4-methylpiperazin-1-yl)-2,3-diphenylpropan-1-one
CID 71449759
1-phenyl-N-(2-piperidin-1-ylethyl)propan-2-amine
CID 114993345
1-benzyl-3-(4-methylpiperazin-1-yl)urea
CID 107653207

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine?
The IUPAC name of 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine (CID 124600300) is 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine.
What is the SMILES notation for 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine?
The canonical SMILES for 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine is C[C@H](Cc1ccccc1)NN1CCN(C)CC1.
What is the InChIKey of 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine?
The InChIKey is AQSVTARLKMNPIF-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H23N3/c1-13(12-14-6-4-3-5-7-14)15-17-10-8-16(2)9-11-17/h3-7,13,15H,8-12H2,1-2H3/t13-/m1/s1.
What are the key properties of 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine?
4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine has a molecular weight of 233.36 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2R)-1-phenylpropan-2-yl]piperazin-1-amine is sourced from PubChem (CID 124600300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).