N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide

C9H19N3O — CID 174509096

IUPACN-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide
SMILESCC1CCCCN1CCN(N)C=O
InChIInChI=1S/C9H19N3O/c1-9-4-2-3-5-11(9)6-7-12(10)8-13/h8-9H,2-7,10H2,1H3
InChIKeyKQFHBGIDJKXUCX-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.19
Rot. Bonds4

About N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide

N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide (PubChem CID 174509096) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide.

Molecular Properties

Compound NameN-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide
PubChem CID174509096
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide
SMILESCC1CCCCN1CCN(N)C=O
InChIInChI=1S/C9H19N3O/c1-9-4-2-3-5-11(9)6-7-12(10)8-13/h8-9H,2-7,10H2,1H3
InChIKeyKQFHBGIDJKXUCX-UHFFFAOYSA-N
XLogP0.19
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-methylpiperidin-1-yl)propanamide
CID 15121454
3-(2-methylpiperidin-1-yl)propyl formate
CID 134501776
N-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]thian-4-amine
CID 50983919
N-methyl-N-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]thian-4-amine
CID 95147822
(2-methylpiperidin-1-yl)methanol
CID 67262865
3-(2-methylpiperidin-1-yl)propanehydrazide
CID 60676133
O-[3-(2-methylpiperidin-1-yl)propyl]hydroxylamine
CID 55270241
1-(3-bromopropyl)-2-methylpiperidine;hydrobromide
CID 71320292
2-methyl-1-pentylazepane
CID 134994557
3-(2-methylpiperidin-1-yl)-N-propylpropan-1-amine
CID 43193223
3-(2-methylpiperidin-1-yl)propane-1-sulfonyl chloride
CID 102548986
1-[2-(dimethylamino)ethyl]pyrrolidine-2-carbaldehyde
CID 102567892

Frequently Asked Questions

What is the IUPAC name of N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide?
The IUPAC name of N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide (CID 174509096) is N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide.
What is the SMILES notation for N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide?
The canonical SMILES for N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide is CC1CCCCN1CCN(N)C=O.
What is the InChIKey of N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide?
The InChIKey is KQFHBGIDJKXUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-9-4-2-3-5-11(9)6-7-12(10)8-13/h8-9H,2-7,10H2,1H3.
What are the key properties of N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide?
N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide has a molecular weight of 185.27 g/mol, XLogP of 0.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N-[2-(2-methylpiperidin-1-yl)ethyl]formamide is sourced from PubChem (CID 174509096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).