N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide

C10H20N2O3 — CID 10536694

IUPACN-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide
SMILESCC(C)C(NC=O)OC(NC=O)C(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)9(11-5-13)15-10(8(3)4)12-6-14/h5-10H,1-4H3,(H,11,13)(H,12,14)
InChIKeyVEOBCTNSJWHFFK-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.46
Rot. Bonds8

About N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide

N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide (PubChem CID 10536694) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide.

Molecular Properties

Compound NameN-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide
PubChem CID10536694
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide
SMILESCC(C)C(NC=O)OC(NC=O)C(C)C
InChIInChI=1S/C10H20N2O3/c1-7(2)9(11-5-13)15-10(8(3)4)12-6-14/h5-10H,1-4H3,(H,11,13)(H,12,14)
InChIKeyVEOBCTNSJWHFFK-UHFFFAOYSA-N
XLogP0.46
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide?
The IUPAC name of N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide (CID 10536694) is N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide.
What is the SMILES notation for N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide?
The canonical SMILES for N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide is CC(C)C(NC=O)OC(NC=O)C(C)C.
What is the InChIKey of N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide?
The InChIKey is VEOBCTNSJWHFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-7(2)9(11-5-13)15-10(8(3)4)12-6-14/h5-10H,1-4H3,(H,11,13)(H,12,14).
What are the key properties of N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide?
N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide has a molecular weight of 216.28 g/mol, XLogP of 0.46, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-formamido-2-methylpropoxy)-2-methylpropyl]formamide is sourced from PubChem (CID 10536694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).