2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate

C11H23N3O2 — CID 83211120

IUPAC2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate
SMILESCCCN1CCC(NCCOC(N)=O)CC1
InChIInChI=1S/C11H23N3O2/c1-2-6-14-7-3-10(4-8-14)13-5-9-16-11(12)15/h10,13H,2-9H2,1H3,(H2,12,15)
InChIKeyFAMUUJAGWQTXGA-UHFFFAOYSA-N
MW229.32 g/mol
LogP0.55
Rot. Bonds6

About 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate

2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate (PubChem CID 83211120) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate.

Molecular Properties

Compound Name2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate
PubChem CID83211120
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate
SMILESCCCN1CCC(NCCOC(N)=O)CC1
InChIInChI=1S/C11H23N3O2/c1-2-6-14-7-3-10(4-8-14)13-5-9-16-11(12)15/h10,13H,2-9H2,1H3,(H2,12,15)
InChIKeyFAMUUJAGWQTXGA-UHFFFAOYSA-N
XLogP0.55
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(4-ethylcyclohexyl)amino]ethyl carbamate
CID 83210087
ethyl 2-[(1-propylpiperidin-4-yl)amino]acetate
CID 60681705
N-(2-cyclohexyloxyethyl)-1-propylpiperidin-4-amine
CID 63826760
2-[(1-propan-2-ylazepan-4-yl)amino]ethyl carbamate
CID 83210079
2-[(1-cyclopropylpyrrolidin-3-yl)amino]ethyl carbamate
CID 83202820
N-(2-methylsulfonylethyl)-1-propylpiperidin-4-amine
CID 60920378
2-methyl-4-[(1-propylpiperidin-4-yl)amino]butan-2-ol
CID 79361096
4-[(1-propylazepan-4-yl)amino]butanoic acid
CID 65073653
N-(3-fluoropropyl)-1-propylpiperidin-4-amine
CID 81106690
2-[(1-propylpiperidin-4-yl)amino]propanamide
CID 43401252
2-[4-(propylamino)piperidin-1-yl]ethanol
CID 60818603
N-[4-(4-propylpiperazin-1-yl)butyl]cyclopropanamine
CID 62424326

Frequently Asked Questions

What is the IUPAC name of 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate?
The IUPAC name of 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate (CID 83211120) is 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate.
What is the SMILES notation for 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate?
The canonical SMILES for 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate is CCCN1CCC(NCCOC(N)=O)CC1.
What is the InChIKey of 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate?
The InChIKey is FAMUUJAGWQTXGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-2-6-14-7-3-10(4-8-14)13-5-9-16-11(12)15/h10,13H,2-9H2,1H3,(H2,12,15).
What are the key properties of 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate?
2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate has a molecular weight of 229.32 g/mol, XLogP of 0.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-propylpiperidin-4-yl)amino]ethyl carbamate is sourced from PubChem (CID 83211120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).