N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide

C16H30N4O2 — CID 2928717

IUPACN-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide
SMILESO=CN(CCN(C=O)CN1CCCCC1)CN1CCCCC1
InChIInChI=1S/C16H30N4O2/c21-15-19(13-17-7-3-1-4-8-17)11-12-20(16-22)14-18-9-5-2-6-10-18/h15-16H,1-14H2
InChIKeyLVRJYOIKHPLLSZ-UHFFFAOYSA-N
MW310.44 g/mol
LogP0.79
Rot. Bonds9

About N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide

N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide (PubChem CID 2928717) has the molecular formula C16H30N4O2 and a molecular weight of 310.44 g/mol. Its IUPAC name is N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide.

Molecular Properties

Compound NameN-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide
PubChem CID2928717
Molecular FormulaC16H30N4O2
Molecular Weight310.44 g/mol
Exact Mass310.24
IUPAC NameN-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide
SMILESO=CN(CCN(C=O)CN1CCCCC1)CN1CCCCC1
InChIInChI=1S/C16H30N4O2/c21-15-19(13-17-7-3-1-4-8-17)11-12-20(16-22)14-18-9-5-2-6-10-18/h15-16H,1-14H2
InChIKeyLVRJYOIKHPLLSZ-UHFFFAOYSA-N
XLogP0.79
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 50.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide?
The IUPAC name of N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide (CID 2928717) is N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide.
What is the SMILES notation for N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide?
The canonical SMILES for N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide is O=CN(CCN(C=O)CN1CCCCC1)CN1CCCCC1.
What is the InChIKey of N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide?
The InChIKey is LVRJYOIKHPLLSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O2/c21-15-19(13-17-7-3-1-4-8-17)11-12-20(16-22)14-18-9-5-2-6-10-18/h15-16H,1-14H2.
What are the key properties of N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide?
N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide has a molecular weight of 310.44 g/mol, XLogP of 0.79, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[formyl(piperidin-1-ylmethyl)amino]ethyl]-N-(piperidin-1-ylmethyl)formamide is sourced from PubChem (CID 2928717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).