N-[3-(2-methylpiperidin-1-yl)propyl]formamide

C10H20N2O — CID 64992718

IUPACN-[3-(2-methylpiperidin-1-yl)propyl]formamide
SMILESCC1CCCCN1CCCNC=O
InChIInChI=1S/C10H20N2O/c1-10-5-2-3-7-12(10)8-4-6-11-9-13/h9-10H,2-8H2,1H3,(H,11,13)
InChIKeyVBUJADPDGQRZFL-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.00
Rot. Bonds5

About N-[3-(2-methylpiperidin-1-yl)propyl]formamide

N-[3-(2-methylpiperidin-1-yl)propyl]formamide (PubChem CID 64992718) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[3-(2-methylpiperidin-1-yl)propyl]formamide.

Molecular Properties

Compound NameN-[3-(2-methylpiperidin-1-yl)propyl]formamide
PubChem CID64992718
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[3-(2-methylpiperidin-1-yl)propyl]formamide
SMILESCC1CCCCN1CCCNC=O
InChIInChI=1S/C10H20N2O/c1-10-5-2-3-7-12(10)8-4-6-11-9-13/h9-10H,2-8H2,1H3,(H,11,13)
InChIKeyVBUJADPDGQRZFL-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylpiperidin-1-yl)propyl]formamide?
The IUPAC name of N-[3-(2-methylpiperidin-1-yl)propyl]formamide (CID 64992718) is N-[3-(2-methylpiperidin-1-yl)propyl]formamide.
What is the SMILES notation for N-[3-(2-methylpiperidin-1-yl)propyl]formamide?
The canonical SMILES for N-[3-(2-methylpiperidin-1-yl)propyl]formamide is CC1CCCCN1CCCNC=O.
What is the InChIKey of N-[3-(2-methylpiperidin-1-yl)propyl]formamide?
The InChIKey is VBUJADPDGQRZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10-5-2-3-7-12(10)8-4-6-11-9-13/h9-10H,2-8H2,1H3,(H,11,13).
What are the key properties of N-[3-(2-methylpiperidin-1-yl)propyl]formamide?
N-[3-(2-methylpiperidin-1-yl)propyl]formamide has a molecular weight of 184.28 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpiperidin-1-yl)propyl]formamide is sourced from PubChem (CID 64992718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).