N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide

C10H21N3 — CID 59020810

IUPACN-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide
SMILES[H]/N=C(\C)N(C)CCN1CCCCC1
InChIInChI=1S/C10H21N3/c1-10(11)12(2)8-9-13-6-4-3-5-7-13/h11H,3-9H2,1-2H3/b11-10+
InChIKeyCWMFMWFYYQWXGO-ZHACJKMWSA-N
MW183.30 g/mol
LogP1.40
Rot. Bonds3

About N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide

N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide (PubChem CID 59020810) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide.

Molecular Properties

Compound NameN-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide
PubChem CID59020810
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC NameN-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide
SMILES[H]/N=C(\C)N(C)CCN1CCCCC1
InChIInChI=1S/C10H21N3/c1-10(11)12(2)8-9-13-6-4-3-5-7-13/h11H,3-9H2,1-2H3/b11-10+
InChIKeyCWMFMWFYYQWXGO-ZHACJKMWSA-N
XLogP1.40
TPSA30.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-Methylpiperidin-2-imine
CID 12449028
1-(Piperidin-1-yl)ethanimine
CID 15794557
1-Piperidineethanimidamide
CID 24703049
1-(4-Fluoropiperidin-1-yl)ethan-1-imine
CID 59020781
6-Fluoro-1-propanimidoylpiperidin-2-imine
CID 155700518
N,N-diethylpentanimidamide
CID 45277197
N,N-dibutylpentanimidamide
CID 177896123
1-(4-Fluoropiperidin-1-yl)butan-1-imine
CID 164659459
1,2-Bis(1-piperidyl)ethanimine
CID 426593
1,2-Di(piperidin-1-yl)ethanimine;hydrochloride
CID 24195697
Piperazine, 1-ethyl-4-(1-iminoethyl)-
CID 12283356
Piperazine, 1-(1-iminopropyl)-4-methyl-
CID 12283364

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide?
The IUPAC name of N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide (CID 59020810) is N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide.
What is the SMILES notation for N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide?
The canonical SMILES for N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide is [H]/N=C(\C)N(C)CCN1CCCCC1.
What is the InChIKey of N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide?
The InChIKey is CWMFMWFYYQWXGO-ZHACJKMWSA-N. The full InChI is InChI=1S/C10H21N3/c1-10(11)12(2)8-9-13-6-4-3-5-7-13/h11H,3-9H2,1-2H3/b11-10+.
What are the key properties of N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide?
N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide has a molecular weight of 183.30 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-piperidin-1-ylethyl)ethanimidamide is sourced from PubChem (CID 59020810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).