cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine

C19H23N — CID 124886159

IUPACcis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine
SMILESC[C@H](N[C@H]1C[C@H]1c1ccccc1)[C@H](C)c1ccccc1
InChIInChI=1S/C19H23N/c1-14(16-9-5-3-6-10-16)15(2)20-19-13-18(19)17-11-7-4-8-12-17/h3-12,14-15,18-20H,13H2,1-2H3/t14-,15-,18-,19-/m0/s1
InChIKeyDZBJOCMBUKBLIO-LNMJFAINSA-N
MW265.40 g/mol
LogP4.32
Rot. Bonds5

About cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine

cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine (PubChem CID 124886159) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine.

Molecular Properties

Compound Namecis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine
PubChem CID124886159
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Namecis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine
SMILESC[C@H](N[C@H]1C[C@H]1c1ccccc1)[C@H](C)c1ccccc1
InChIInChI=1S/C19H23N/c1-14(16-9-5-3-6-10-16)15(2)20-19-13-18(19)17-11-7-4-8-12-17/h3-12,14-15,18-20H,13H2,1-2H3/t14-,15-,18-,19-/m0/s1
InChIKeyDZBJOCMBUKBLIO-LNMJFAINSA-N
XLogP4.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenyl-N-(1-phenylbutyl)cyclopropan-1-amine
CID 63454721
N-[1-(4-chloro-3-fluorophenyl)ethyl]-2-phenylcyclopropan-1-amine
CID 83069385
(2S)-1-[(2-phenylcyclopropyl)amino]propan-2-ol
CID 106932009
2-N-methyl-1-N-(2-phenylcyclopropyl)propane-1,2-diamine
CID 62632238
N-chloro-3-phenylbutan-2-amine
CID 89161860
4-[1-[[(1R,2S)-2-phenylcyclopropyl]amino]ethyl]piperidine-1-carboxylic acid
CID 174804524
cis-(1R,2R)-N-[1-(oxan-3-yl)ethyl]-2-phenylcyclopropan-1-amine
CID 167856974
2-[(2-phenylcyclopropyl)amino]butanamide
CID 62901755
(2S)-2-amino-N-(2-phenylcyclopropyl)propanamide
CID 78977151
2,3-dimethyl-N-[(1S,2R)-2-phenylcyclopropyl]butanamide
CID 118334207
2-methyl-3-oxo-3-[(2-phenylcyclopropyl)amino]propanoic acid
CID 114898248
N-[1-(1,3-dimethylpyrazol-4-yl)ethyl]-2-phenylcyclopropan-1-amine
CID 65197378

Frequently Asked Questions

What is the IUPAC name of cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine?
The IUPAC name of cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine (CID 124886159) is cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine.
What is the SMILES notation for cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine?
The canonical SMILES for cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine is C[C@H](N[C@H]1C[C@H]1c1ccccc1)[C@H](C)c1ccccc1.
What is the InChIKey of cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine?
The InChIKey is DZBJOCMBUKBLIO-LNMJFAINSA-N. The full InChI is InChI=1S/C19H23N/c1-14(16-9-5-3-6-10-16)15(2)20-19-13-18(19)17-11-7-4-8-12-17/h3-12,14-15,18-20H,13H2,1-2H3/t14-,15-,18-,19-/m0/s1.
What are the key properties of cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine?
cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2S)-2-phenyl-N-[(2S,3R)-3-phenylbutan-2-yl]cyclopropan-1-amine is sourced from PubChem (CID 124886159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).