1-ethyl-N-(2-methylbutyl)piperidin-4-amine

C12H26N2 — CID 61038759

IUPAC1-ethyl-N-(2-methylbutyl)piperidin-4-amine
SMILESCCC(C)CNC1CCN(CC)CC1
InChIInChI=1S/C12H26N2/c1-4-11(3)10-13-12-6-8-14(5-2)9-7-12/h11-13H,4-10H2,1-3H3
InChIKeyDITWSJHVUXVULF-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.11
Rot. Bonds5

About 1-ethyl-N-(2-methylbutyl)piperidin-4-amine

1-ethyl-N-(2-methylbutyl)piperidin-4-amine (PubChem CID 61038759) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 1-ethyl-N-(2-methylbutyl)piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(2-methylbutyl)piperidin-4-amine
PubChem CID61038759
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name1-ethyl-N-(2-methylbutyl)piperidin-4-amine
SMILESCCC(C)CNC1CCN(CC)CC1
InChIInChI=1S/C12H26N2/c1-4-11(3)10-13-12-6-8-14(5-2)9-7-12/h11-13H,4-10H2,1-3H3
InChIKeyDITWSJHVUXVULF-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-N-(2-methylbutyl)pyrrolidin-3-amine
CID 142317585
2-[4-(2-methylbutylamino)piperidin-1-yl]acetonitrile
CID 115887467
1-ethyl-N-(2-methyl-3-piperidin-1-ylpropyl)piperidin-4-amine
CID 54906375
N-(2-methylbutyl)-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 62693274
1-cyclopropyl-N-(2-methylbutyl)piperidin-4-amine
CID 43746988
N-(2-methylbutyl)cyclopentanamine
CID 43200714
1-[(1-ethylpiperidin-4-yl)amino]-4-methylpentan-2-ol
CID 115714806
4-(2-methylbutylamino)piperidine-1-carboxamide
CID 62692212
1-ethyl-2-methyl-N-(2-methylbutyl)piperidin-4-amine
CID 115887559
N-butan-2-yl-1-ethylpiperidin-4-amine
CID 43177306
N'-cyclopropyl-1-(1-ethylpiperidin-4-yl)ethane-1,2-diamine
CID 117238537
N-(1-ethylpiperidin-4-yl)-N'-propan-2-ylethane-1,2-diamine
CID 146359522

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-methylbutyl)piperidin-4-amine?
The IUPAC name of 1-ethyl-N-(2-methylbutyl)piperidin-4-amine (CID 61038759) is 1-ethyl-N-(2-methylbutyl)piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-(2-methylbutyl)piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-(2-methylbutyl)piperidin-4-amine is CCC(C)CNC1CCN(CC)CC1.
What is the InChIKey of 1-ethyl-N-(2-methylbutyl)piperidin-4-amine?
The InChIKey is DITWSJHVUXVULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-11(3)10-13-12-6-8-14(5-2)9-7-12/h11-13H,4-10H2,1-3H3.
What are the key properties of 1-ethyl-N-(2-methylbutyl)piperidin-4-amine?
1-ethyl-N-(2-methylbutyl)piperidin-4-amine has a molecular weight of 198.35 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-methylbutyl)piperidin-4-amine is sourced from PubChem (CID 61038759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).