N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen

C11H26N2 — CID 164555849

IUPACN-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen
SMILESCCN(C[C@@H]1CCCCN1)C(C)C.[H][H]
InChIInChI=1S/C11H24N2.H2/c1-4-13(10(2)3)9-11-7-5-6-8-12-11;/h10-12H,4-9H2,1-3H3;1H/t11-;/m0./s1
InChIKeyZAEAVAYZPGCQHO-MERQFXBCSA-N
MW186.34 g/mol
LogP2.10
Rot. Bonds4

About N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen

N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen (PubChem CID 164555849) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen.

Molecular Properties

Compound NameN-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen
PubChem CID164555849
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC NameN-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen
SMILESCCN(C[C@@H]1CCCCN1)C(C)C.[H][H]
InChIInChI=1S/C11H24N2.H2/c1-4-13(10(2)3)9-11-7-5-6-8-12-11;/h10-12H,4-9H2,1-3H3;1H/t11-;/m0./s1
InChIKeyZAEAVAYZPGCQHO-MERQFXBCSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 43265935
N-ethyl-N-(pyrrolidin-2-ylmethyl)butan-2-amine
CID 43274680
N-(piperidin-2-ylmethyl)-N-propan-2-ylbut-2-yn-1-amine
CID 106632063
N-ethyl-3-methoxy-N-(piperidin-2-ylmethyl)butan-2-amine
CID 106622534
(E)-N-(piperidin-2-ylmethyl)-N-propan-2-ylbut-2-en-1-amine
CID 106632187
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
1-cyclobutyl-N-ethyl-N-(pyrrolidin-2-ylmethyl)propan-2-amine
CID 106603623
N-ethyl-N-(pyrrolidin-2-ylmethyl)but-3-yn-2-amine
CID 106615574
6-[piperidin-2-ylmethyl(propan-2-yl)amino]hexan-1-ol
CID 107705711
methyl 3-[ethyl(piperidin-2-ylmethyl)amino]butanoate
CID 106632589
N-methyl-N-[[(2R)-pyrrolidin-2-yl]methyl]propan-2-amine;molecular hydrogen
CID 177210581
N-[(4-chloro-1-ethyl-3-methylpyrazol-5-yl)methyl]-N-(piperidin-2-ylmethyl)propan-2-amine
CID 106632130

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen?
The IUPAC name of N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen (CID 164555849) is N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen.
What is the SMILES notation for N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen?
The canonical SMILES for N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen is CCN(C[C@@H]1CCCCN1)C(C)C.[H][H].
What is the InChIKey of N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen?
The InChIKey is ZAEAVAYZPGCQHO-MERQFXBCSA-N. The full InChI is InChI=1S/C11H24N2.H2/c1-4-13(10(2)3)9-11-7-5-6-8-12-11;/h10-12H,4-9H2,1-3H3;1H/t11-;/m0./s1.
What are the key properties of N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen?
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen has a molecular weight of 186.34 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]propan-2-amine;molecular hydrogen is sourced from PubChem (CID 164555849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).