N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide

C16H33N3O — CID 106275512

IUPACN,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide
SMILESCCCN1CCCC(C(C)NCC(C)(C)C(=O)NC)C1
InChIInChI=1S/C16H33N3O/c1-6-9-19-10-7-8-14(11-19)13(2)18-12-16(3,4)15(20)17-5/h13-14,18H,6-12H2,1-5H3,(H,17,20)
InChIKeyCJCSPZQERIBNPK-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.86
Rot. Bonds7

About N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide

N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide (PubChem CID 106275512) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide
PubChem CID106275512
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC NameN,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide
SMILESCCCN1CCCC(C(C)NCC(C)(C)C(=O)NC)C1
InChIInChI=1S/C16H33N3O/c1-6-9-19-10-7-8-14(11-19)13(2)18-12-16(3,4)15(20)17-5/h13-14,18H,6-12H2,1-5H3,(H,17,20)
InChIKeyCJCSPZQERIBNPK-UHFFFAOYSA-N
XLogP1.86
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,2-dimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propan-1-ol
CID 113293730
3-[[1-(1-propylpiperidin-3-yl)ethylamino]methyl]pentan-3-ol
CID 65105569
N-[2-methyl-1-[1-(1-propylpiperidin-3-yl)ethylamino]propan-2-yl]methanesulfonamide
CID 63859843
tert-butyl N-[1-[1-(1-propylpiperidin-3-yl)ethylamino]propan-2-yl]carbamate
CID 107247379
5-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]hexan-1-amine
CID 115325204
N-[1-(1-propylpiperidin-3-yl)ethyl]pentan-1-amine
CID 43307476
2-(methylamino)-2-(1-propylpiperidin-3-yl)acetic acid
CID 83982898
N-ethyl-1-(1-pentylpiperidin-3-yl)ethanamine
CID 63852706
(1R)-1-[(3R)-1-propylpiperidin-3-yl]ethanol
CID 51697339
1-(1-propylpiperidin-3-yl)-N-[2-(trifluoromethylsulfanyl)ethyl]ethanamine
CID 106426780
3-methyl-N-[1-(1-propylpiperidin-3-yl)ethyl]butan-2-amine
CID 43308725
N-(oxan-4-ylmethyl)-1-(1-propylpiperidin-3-yl)ethanamine
CID 63726467

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide?
The IUPAC name of N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide (CID 106275512) is N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide?
The canonical SMILES for N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide is CCCN1CCCC(C(C)NCC(C)(C)C(=O)NC)C1.
What is the InChIKey of N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide?
The InChIKey is CJCSPZQERIBNPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-6-9-19-10-7-8-14(11-19)13(2)18-12-16(3,4)15(20)17-5/h13-14,18H,6-12H2,1-5H3,(H,17,20).
What are the key properties of N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide?
N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide has a molecular weight of 283.46 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-[1-(1-propylpiperidin-3-yl)ethylamino]propanamide is sourced from PubChem (CID 106275512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).