N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine

C13H28N2 — CID 106329162

IUPACN-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCNC1CCN(C(C)(CC)CC)CC1
InChIInChI=1S/C13H28N2/c1-5-13(4,6-2)15-10-8-12(9-11-15)14-7-3/h12,14H,5-11H2,1-4H3
InChIKeyKCXXWAOACCUEGP-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.64
Rot. Bonds5

About N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine

N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine (PubChem CID 106329162) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
PubChem CID106329162
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCNC1CCN(C(C)(CC)CC)CC1
InChIInChI=1S/C13H28N2/c1-5-13(4,6-2)15-10-8-12(9-11-15)14-7-3/h12,14H,5-11H2,1-4H3
InChIKeyKCXXWAOACCUEGP-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(trifluoromethyl)piperidin-4-amine
CID 71635365
N-ethyl-2-methyl-1-(3-methylpentan-3-yl)piperidin-4-amine
CID 106329207
N-tert-butyl-4-(ethylamino)piperidine-1-carboxamide
CID 60819470
N-ethylcyclopropanamine;hydrochloride
CID 43810659
N-ethyl-9-(3-methylpentan-3-yl)-9-azabicyclo[3.3.1]nonan-3-amine
CID 106329578
N-ethyl-1-propan-2-ylpiperidin-4-amine
CID 24692919
N-ethyl-1-(2-pyrrolidin-1-ylethyl)piperidin-4-amine
CID 107910858
1-cyclopentyl-N-ethylpiperidin-4-amine
CID 43315368
1-[4-(ethylamino)piperidin-1-yl]-2,3-dimethylbutan-2-ol
CID 114491211
(3R)-N-methyl-1-(3-methylheptan-3-yl)pyrrolidin-3-amine
CID 139373164
1-(3-methylpentan-3-yl)-N-propylpiperidin-3-amine
CID 106329682
N-ethyl-1-(3-ethylpentan-3-yl)piperidin-3-amine
CID 65043436

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine (CID 106329162) is N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine is CCNC1CCN(C(C)(CC)CC)CC1.
What is the InChIKey of N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
The InChIKey is KCXXWAOACCUEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-13(4,6-2)15-10-8-12(9-11-15)14-7-3/h12,14H,5-11H2,1-4H3.
What are the key properties of N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine?
N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine has a molecular weight of 212.38 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methylpentan-3-yl)piperidin-4-amine is sourced from PubChem (CID 106329162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).