N-(pyrrolidin-2-ylmethyl)formamide

C6H12N2O — CID 72555497

IUPACN-(pyrrolidin-2-ylmethyl)formamide
SMILESO=CNCC1CCCN1
InChIInChI=1S/C6H12N2O/c9-5-7-4-6-2-1-3-8-6/h5-6,8H,1-4H2,(H,7,9)
InChIKeyVYXNQGVCCILXKN-UHFFFAOYSA-N
MW128.18 g/mol
LogP-0.52
Rot. Bonds3

About N-(pyrrolidin-2-ylmethyl)formamide

N-(pyrrolidin-2-ylmethyl)formamide (PubChem CID 72555497) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is N-(pyrrolidin-2-ylmethyl)formamide.

Molecular Properties

Compound NameN-(pyrrolidin-2-ylmethyl)formamide
PubChem CID72555497
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC NameN-(pyrrolidin-2-ylmethyl)formamide
SMILESO=CNCC1CCCN1
InChIInChI=1S/C6H12N2O/c9-5-7-4-6-2-1-3-8-6/h5-6,8H,1-4H2,(H,7,9)
InChIKeyVYXNQGVCCILXKN-UHFFFAOYSA-N
XLogP-0.52
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[(2S)-pyrrolidin-2-yl]methoxy]formamide
CID 142306542
N-[[(2S)-pyrrolidin-2-yl]methyl]hydroxylamine
CID 91407987
N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 59418450
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine
CID 106633110
5-(pyrrolidin-2-ylmethylamino)pentan-1-ol
CID 107316712
N-methyl-1-pyrrolidin-2-ylmethanamine;molecular hydrogen
CID 153348528
3-formamido-N-(pyrrolidin-2-ylmethoxy)propanamide
CID 145222768
2-(pyrrolidin-2-ylmethylamino)ethanesulfonamide
CID 106636953
N-(cyclobutylmethyl)-2-pyrrolidin-2-ylacetamide
CID 61372732
2-chloro-N-(pyrrolidin-2-ylmethyl)acetamide
CID 71302527
1,1-dimethyl-2-(pyrrolidin-2-ylmethyl)hydrazine
CID 106639129
N-(piperidin-2-ylmethyl)ethanamine
CID 11970483

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-2-ylmethyl)formamide?
The IUPAC name of N-(pyrrolidin-2-ylmethyl)formamide (CID 72555497) is N-(pyrrolidin-2-ylmethyl)formamide.
What is the SMILES notation for N-(pyrrolidin-2-ylmethyl)formamide?
The canonical SMILES for N-(pyrrolidin-2-ylmethyl)formamide is O=CNCC1CCCN1.
What is the InChIKey of N-(pyrrolidin-2-ylmethyl)formamide?
The InChIKey is VYXNQGVCCILXKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c9-5-7-4-6-2-1-3-8-6/h5-6,8H,1-4H2,(H,7,9).
What are the key properties of N-(pyrrolidin-2-ylmethyl)formamide?
N-(pyrrolidin-2-ylmethyl)formamide has a molecular weight of 128.18 g/mol, XLogP of -0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-2-ylmethyl)formamide is sourced from PubChem (CID 72555497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).