N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine

C20H30N2 — CID 119165181

IUPACN-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine
SMILESc1ccc(CCN2CCC(NC(C3CC3)C3CC3)CC2)cc1
InChIInChI=1S/C20H30N2/c1-2-4-16(5-3-1)10-13-22-14-11-19(12-15-22)21-20(17-6-7-17)18-8-9-18/h1-5,17-21H,6-15H2
InChIKeyZFYPHFGBSYWWRZ-UHFFFAOYSA-N
MW298.47 g/mol
LogP3.47
Rot. Bonds7

About N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine

N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine (PubChem CID 119165181) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine
PubChem CID119165181
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC NameN-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine
SMILESc1ccc(CCN2CCC(NC(C3CC3)C3CC3)CC2)cc1
InChIInChI=1S/C20H30N2/c1-2-4-16(5-3-1)10-13-22-14-11-19(12-15-22)21-20(17-6-7-17)18-8-9-18/h1-5,17-21H,6-15H2
InChIKeyZFYPHFGBSYWWRZ-UHFFFAOYSA-N
XLogP3.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[1-(2-phenylethyl)piperidin-4-yl]amino]propanoic acid
CID 61499758
N,1-bis(2-phenylethyl)piperidin-4-amine
CID 24785666
1-(2-phenylethyl)-4-propan-2-ylpiperidine
CID 18683008
N-[(R)-cyclopropyl-(1-methylimidazol-2-yl)methyl]-1-(2-phenylethyl)piperidin-4-amine
CID 124619726
1-(2-phenylethyl)-N-pyrrol-1-ylpiperidin-4-amine
CID 13306762
N-ethenyl-1-(2-phenylethyl)piperidin-4-amine
CID 166738231
1-(2-phenylethyl)-N-(1-propan-2-ylpiperidin-4-yl)piperidin-4-amine
CID 119165057
N-[(1-fluorocyclopropyl)methyl]-1-(2-phenylethyl)piperidin-4-amine
CID 136538799
1-[1-(2-phenylethyl)piperidin-4-yl]ethanol
CID 103656947
(2R)-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]propan-1-ol
CID 114986909
(R)-phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanol
CID 6604770
2-methyl-3-[[1-(2-phenylethyl)piperidin-4-yl]amino]propan-1-ol
CID 65034212

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine?
The IUPAC name of N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine (CID 119165181) is N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine?
The canonical SMILES for N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine is c1ccc(CCN2CCC(NC(C3CC3)C3CC3)CC2)cc1.
What is the InChIKey of N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine?
The InChIKey is ZFYPHFGBSYWWRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2/c1-2-4-16(5-3-1)10-13-22-14-11-19(12-15-22)21-20(17-6-7-17)18-8-9-18/h1-5,17-21H,6-15H2.
What are the key properties of N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine?
N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine has a molecular weight of 298.47 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-(2-phenylethyl)piperidin-4-amine is sourced from PubChem (CID 119165181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).