N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide

C15H21N3 — CID 111024258

IUPACN'-cyclopropyl-N-phenylpiperidine-1-carboximidamide
SMILESc1ccc(N/C(=N/C2CC2)N2CCCCC2)cc1
InChIInChI=1S/C15H21N3/c1-3-7-13(8-4-1)16-15(17-14-9-10-14)18-11-5-2-6-12-18/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,16,17)
InChIKeySISGGCRHBXFIDT-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.10
Rot. Bonds2

About N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide

N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide (PubChem CID 111024258) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide.

Molecular Properties

Compound NameN'-cyclopropyl-N-phenylpiperidine-1-carboximidamide
PubChem CID111024258
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN'-cyclopropyl-N-phenylpiperidine-1-carboximidamide
SMILESc1ccc(N/C(=N/C2CC2)N2CCCCC2)cc1
InChIInChI=1S/C15H21N3/c1-3-7-13(8-4-1)16-15(17-14-9-10-14)18-11-5-2-6-12-18/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,16,17)
InChIKeySISGGCRHBXFIDT-UHFFFAOYSA-N
XLogP3.10
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

N'-benzyl-N-phenylpyrrolidine-1-carboximidamide
CID 12889972
N-(3-acetylphenyl)-N'-[4-[(4-aminocyclohexyl)methyl]cyclohexyl]piperidine-1-carboximidamide
CID 134121819
N'-[(1,1-dioxothian-4-yl)methyl]-N-phenylpiperidine-1-carboximidamide
CID 109468009
N'-(4-methylphenyl)-N-phenylpiperidine-1-carboximidamide
CID 138974908
N'-[(1-cyclopropylpyrrolidin-3-yl)methyl]-N-phenylpiperidine-1-carboximidamide
CID 111065646
N'-[3-(cyclopropylmethoxy)propyl]-N-phenylpiperidine-1-carboximidamide
CID 111035250
N-(5-tert-butyl-2-hydroxyphenyl)-N'-cyclopropylpiperidine-1-carboximidamide
CID 134121786
N'-[3-(2-hydroxyethoxy)propyl]-N-phenylpiperidine-1-carboximidamide
CID 110018572
2-cyclohexyl-1-phenylguanidine
CID 10900077
N'-(2-ethyl-2-hydroxybutyl)-N-phenylpiperidine-1-carboximidamide
CID 111089079
N'-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-N-phenylpiperidine-1-carboximidamide
CID 119147661
N'-[2-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethyl]-N-phenylpiperidine-1-carboximidamide
CID 111806060

Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide?
The IUPAC name of N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide (CID 111024258) is N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide.
What is the SMILES notation for N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide?
The canonical SMILES for N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide is c1ccc(N/C(=N/C2CC2)N2CCCCC2)cc1.
What is the InChIKey of N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide?
The InChIKey is SISGGCRHBXFIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-3-7-13(8-4-1)16-15(17-14-9-10-14)18-11-5-2-6-12-18/h1,3-4,7-8,14H,2,5-6,9-12H2,(H,16,17).
What are the key properties of N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide?
N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide has a molecular weight of 243.35 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N-phenylpiperidine-1-carboximidamide is sourced from PubChem (CID 111024258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).