N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide

C16H33N3O — CID 116653952

IUPACN-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)N1CCCC(C)C1
InChIInChI=1S/C16H33N3O/c1-5-18(6-2)11-8-10-15(4)17-16(20)19-12-7-9-14(3)13-19/h14-15H,5-13H2,1-4H3,(H,17,20)
InChIKeyWSXUBVPLOJESMH-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.94
Rot. Bonds7

About N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide

N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide (PubChem CID 116653952) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide
PubChem CID116653952
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide
SMILESCCN(CC)CCCC(C)NC(=O)N1CCCC(C)C1
InChIInChI=1S/C16H33N3O/c1-5-18(6-2)11-8-10-15(4)17-16(20)19-12-7-9-14(3)13-19/h14-15H,5-13H2,1-4H3,(H,17,20)
InChIKeyWSXUBVPLOJESMH-UHFFFAOYSA-N
XLogP2.94
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-hexan-2-yl-3-methylpiperidine-1-carboxamide
CID 116655502
3-methyl-N-(4-methylpentan-2-yl)piperidine-1-carboxamide
CID 115760637
1-[5-(diethylamino)pentan-2-yl]-2-methyl-3-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]guanidine;hydroiodide
CID 110998832
3-methyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 60577941
N-(4-amino-4-oxobutan-2-yl)-3-methylpiperidine-1-carboxamide
CID 116657977
(3S)-3-methyl-N-[(2S)-4-methylsulfonylbutan-2-yl]piperidine-1-carboxamide
CID 97108959
3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583842
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-[(2S)-5-(diethylamino)pentan-2-yl]-4-pyridin-3-ylpiperazine-1-carboxamide
CID 126437488
3-[ethyl-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]amino]propanoic acid
CID 54899890
5-[(3-hydroxypiperidine-1-carbonyl)amino]hexanoic acid
CID 82848661
4-N-cyclopropyl-1-N,1-N-diethylpentane-1,4-diamine
CID 103438826

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide?
The IUPAC name of N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide (CID 116653952) is N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide is CCN(CC)CCCC(C)NC(=O)N1CCCC(C)C1.
What is the InChIKey of N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide?
The InChIKey is WSXUBVPLOJESMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-18(6-2)11-8-10-15(4)17-16(20)19-12-7-9-14(3)13-19/h14-15H,5-13H2,1-4H3,(H,17,20).
What are the key properties of N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide?
N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide has a molecular weight of 283.46 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylamino)pentan-2-yl]-3-methylpiperidine-1-carboxamide is sourced from PubChem (CID 116653952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).