N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine

C14H24N4 — CID 126609529

IUPACN-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine
SMILESCN1CCC(NC[C@@H](NN)c2ccccc2)CC1
InChIInChI=1S/C14H24N4/c1-18-9-7-13(8-10-18)16-11-14(17-15)12-5-3-2-4-6-12/h2-6,13-14,16-17H,7-11,15H2,1H3/t14-/m1/s1
InChIKeyWCUSWCUEJGHAAQ-CQSZACIVSA-N
MW248.37 g/mol
LogP0.87
Rot. Bonds5

About N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine

N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine (PubChem CID 126609529) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine
PubChem CID126609529
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine
SMILESCN1CCC(NC[C@@H](NN)c2ccccc2)CC1
InChIInChI=1S/C14H24N4/c1-18-9-7-13(8-10-18)16-11-14(17-15)12-5-3-2-4-6-12/h2-6,13-14,16-17H,7-11,15H2,1H3/t14-/m1/s1
InChIKeyWCUSWCUEJGHAAQ-CQSZACIVSA-N
XLogP0.87
TPSA53.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-N'-(1-methylazepan-4-yl)-1-phenylethane-1,2-diamine
CID 65071440
1-methyl-N-(3-methyl-1-phenylbutyl)piperidin-4-amine
CID 43216052
1-[(1-methylpiperidin-4-yl)amino]-3-phenylpropan-2-ol
CID 111755497
1-[(1-methylpiperidin-4-yl)amino]-3-(1-phenylethoxy)propan-2-ol
CID 60910129
N-(2-benzylbutyl)-1-methylpiperidin-4-amine
CID 50954737
N-benzyl-1-methylpiperidin-4-amine
CID 1114650
1-(2-chlorophenyl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
CID 60910522
N-benzhydryl-1-methylpiperidin-4-amine;dihydrochloride
CID 134094585
1-methyl-N-(2-phenylsulfanylethyl)piperidin-4-amine
CID 60664696
N-(1,2-diphenylethyl)-1-methylpyrrolidin-3-amine
CID 61462426
1-(furan-2-yl)-2-[(1-methylpiperidin-4-yl)amino]ethanol
CID 60910521
N-(2-methoxy-1-phenylethyl)-1-methylpyrrolidin-3-amine
CID 103902264

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine?
The IUPAC name of N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine (CID 126609529) is N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine.
What is the SMILES notation for N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine?
The canonical SMILES for N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine is CN1CCC(NC[C@@H](NN)c2ccccc2)CC1.
What is the InChIKey of N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine?
The InChIKey is WCUSWCUEJGHAAQ-CQSZACIVSA-N. The full InChI is InChI=1S/C14H24N4/c1-18-9-7-13(8-10-18)16-11-14(17-15)12-5-3-2-4-6-12/h2-6,13-14,16-17H,7-11,15H2,1H3/t14-/m1/s1.
What are the key properties of N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine?
N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 0.87, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-hydrazinyl-2-phenylethyl]-1-methylpiperidin-4-amine is sourced from PubChem (CID 126609529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).