N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide

C18H34N2O — CID 83198749

IUPACN-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESC[C@@H](NC(=O)C(C)(C)C1CCCNC1)C1CCCCCC1
InChIInChI=1S/C18H34N2O/c1-14(15-9-6-4-5-7-10-15)20-17(21)18(2,3)16-11-8-12-19-13-16/h14-16,19H,4-13H2,1-3H3,(H,20,21)/t14-,16?/m1/s1
InChIKeyBVHUKKRZDPGBOH-IURRXHLWSA-N
MW294.48 g/mol
LogP3.49
Rot. Bonds4

About N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide

N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide (PubChem CID 83198749) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide
PubChem CID83198749
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC NameN-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide
SMILESC[C@@H](NC(=O)C(C)(C)C1CCCNC1)C1CCCCCC1
InChIInChI=1S/C18H34N2O/c1-14(15-9-6-4-5-7-10-15)20-17(21)18(2,3)16-11-8-12-19-13-16/h14-16,19H,4-13H2,1-3H3,(H,20,21)/t14-,16?/m1/s1
InChIKeyBVHUKKRZDPGBOH-IURRXHLWSA-N
XLogP3.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-methyl-2-piperidin-3-ylpropanamide
CID 83032368
2-cyclopropyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]acetic acid
CID 83198884
N,2-dimethyl-2-piperidin-3-ylpropanamide
CID 83031239
N-[1-(ethylamino)-1-oxopropan-2-yl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83031807
2-methyl-N-(2-methylpropyl)-2-piperidin-3-ylpropanamide
CID 83032464
2-methyl-N-[(1R)-1-(4-methylphenyl)ethyl]-2-piperidin-3-ylpropanamide
CID 83200384
methyl 4-methyl-2-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]pentanoate
CID 83198704
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200383
N-[(1S)-1-(4-bromophenyl)ethyl]-2-methyl-2-piperidin-3-ylpropanamide
CID 83200389
2-methyl-N-[3-oxo-3-(propan-2-ylamino)propyl]-2-piperidin-3-ylpropanamide
CID 115881590
N',N',2-trimethyl-2-piperidin-3-ylpropanehydrazide
CID 83199911
2-methyl-3-[(2-methyl-2-piperidin-3-ylpropanoyl)amino]propanoic acid
CID 83198731

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The IUPAC name of N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide (CID 83198749) is N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide.
What is the SMILES notation for N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The canonical SMILES for N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide is C[C@@H](NC(=O)C(C)(C)C1CCCNC1)C1CCCCCC1.
What is the InChIKey of N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide?
The InChIKey is BVHUKKRZDPGBOH-IURRXHLWSA-N. The full InChI is InChI=1S/C18H34N2O/c1-14(15-9-6-4-5-7-10-15)20-17(21)18(2,3)16-11-8-12-19-13-16/h14-16,19H,4-13H2,1-3H3,(H,20,21)/t14-,16?/m1/s1.
What are the key properties of N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide?
N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide has a molecular weight of 294.48 g/mol, XLogP of 3.49, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-cycloheptylethyl]-2-methyl-2-piperidin-3-ylpropanamide is sourced from PubChem (CID 83198749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).