N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine

C11H22N4O2 — CID 143394746

IUPACN-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine
SMILESC1CCNC1.CN(C=O)NC(=O)C1CCCN1
InChIInChI=1S/C7H13N3O2.C4H9N/c1-10(5-11)9-7(12)6-3-2-4-8-6;1-2-4-5-3-1/h5-6,8H,2-4H2,1H3,(H,9,12);5H,1-4H2
InChIKeyLSPLDINHGMZPSL-UHFFFAOYSA-N
MW242.32 g/mol
LogP-0.77
Rot. Bonds3

About N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine

N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine (PubChem CID 143394746) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine.

Molecular Properties

Compound NameN-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine
PubChem CID143394746
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC NameN-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine
SMILESC1CCNC1.CN(C=O)NC(=O)C1CCCN1
InChIInChI=1S/C7H13N3O2.C4H9N/c1-10(5-11)9-7(12)6-3-2-4-8-6;1-2-4-5-3-1/h5-6,8H,2-4H2,1H3,(H,9,12);5H,1-4H2
InChIKeyLSPLDINHGMZPSL-UHFFFAOYSA-N
XLogP-0.77
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine?
The IUPAC name of N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine (CID 143394746) is N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine.
What is the SMILES notation for N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine?
The canonical SMILES for N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine is C1CCNC1.CN(C=O)NC(=O)C1CCCN1.
What is the InChIKey of N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine?
The InChIKey is LSPLDINHGMZPSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3O2.C4H9N/c1-10(5-11)9-7(12)6-3-2-4-8-6;1-2-4-5-3-1/h5-6,8H,2-4H2,1H3,(H,9,12);5H,1-4H2.
What are the key properties of N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine?
N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine has a molecular weight of 242.32 g/mol, XLogP of -0.77, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyrrolidine-2-carbonylamino)formamide;pyrrolidine is sourced from PubChem (CID 143394746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).