ethane;N-methyl-1-piperidin-2-ylmethanamine

C9H22N2 — CID 144727857

IUPACethane;N-methyl-1-piperidin-2-ylmethanamine
SMILESCC.CNCC1CCCCN1
InChIInChI=1S/C7H16N2.C2H6/c1-8-6-7-4-2-3-5-9-7;1-2/h7-9H,2-6H2,1H3;1-2H3
InChIKeyHIMGNKZSNWNXOW-UHFFFAOYSA-N
MW158.29 g/mol
LogP1.37
Rot. Bonds2

About ethane;N-methyl-1-piperidin-2-ylmethanamine

ethane;N-methyl-1-piperidin-2-ylmethanamine (PubChem CID 144727857) has the molecular formula C9H22N2 and a molecular weight of 158.29 g/mol. Its IUPAC name is ethane;N-methyl-1-piperidin-2-ylmethanamine.

Molecular Properties

Compound Nameethane;N-methyl-1-piperidin-2-ylmethanamine
PubChem CID144727857
Molecular FormulaC9H22N2
Molecular Weight158.29 g/mol
Exact Mass158.18
IUPAC Nameethane;N-methyl-1-piperidin-2-ylmethanamine
SMILESCC.CNCC1CCCCN1
InChIInChI=1S/C7H16N2.C2H6/c1-8-6-7-4-2-3-5-9-7;1-2/h7-9H,2-6H2,1H3;1-2H3
InChIKeyHIMGNKZSNWNXOW-UHFFFAOYSA-N
XLogP1.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.29
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-1-pyrrolidin-2-ylmethanamine;molecular hydrogen
CID 153348528
N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine
CID 59332807
N-methyl-2-piperidin-2-ylethanamine
CID 13073020
N-(piperidin-2-ylmethyl)ethanamine
CID 11970483
N-(piperidin-2-ylmethyl)cyclooctanamine
CID 106632850
1-(1,4-diazepan-5-yl)-N-methylmethanamine
CID 23090284
2,2-dimethyl-N-(piperidin-2-ylmethyl)propan-1-amine
CID 61167867
N-methyl-5-piperidin-2-ylpentan-1-amine
CID 166838615
piperidin-2-ylmethylcyanamide
CID 105428074
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine
CID 106633110
2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanesulfonamide
CID 63245222
5-methyl-N-(piperidin-2-ylmethyl)hexan-1-amine
CID 115325988

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-1-piperidin-2-ylmethanamine?
The IUPAC name of ethane;N-methyl-1-piperidin-2-ylmethanamine (CID 144727857) is ethane;N-methyl-1-piperidin-2-ylmethanamine.
What is the SMILES notation for ethane;N-methyl-1-piperidin-2-ylmethanamine?
The canonical SMILES for ethane;N-methyl-1-piperidin-2-ylmethanamine is CC.CNCC1CCCCN1.
What is the InChIKey of ethane;N-methyl-1-piperidin-2-ylmethanamine?
The InChIKey is HIMGNKZSNWNXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.C2H6/c1-8-6-7-4-2-3-5-9-7;1-2/h7-9H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;N-methyl-1-piperidin-2-ylmethanamine?
ethane;N-methyl-1-piperidin-2-ylmethanamine has a molecular weight of 158.29 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-1-piperidin-2-ylmethanamine is sourced from PubChem (CID 144727857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).