N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine

C14H26N2 — CID 114620607

IUPACN-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine
SMILESCCN(CC1CCNCC1)C1C=CCCC1
InChIInChI=1S/C14H26N2/c1-2-16(14-6-4-3-5-7-14)12-13-8-10-15-11-9-13/h4,6,13-15H,2-3,5,7-12H2,1H3
InChIKeyYTUIOPGAPIBLMV-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.42
Rot. Bonds4

About N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine

N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine (PubChem CID 114620607) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine.

Molecular Properties

Compound NameN-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine
PubChem CID114620607
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine
SMILESCCN(CC1CCNCC1)C1C=CCCC1
InChIInChI=1S/C14H26N2/c1-2-16(14-6-4-3-5-7-14)12-13-8-10-15-11-9-13/h4,6,13-15H,2-3,5,7-12H2,1H3
InChIKeyYTUIOPGAPIBLMV-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohex-2-en-1-yl-N-ethylazetidin-3-amine
CID 114620591
N-ethyl-4-methyl-N-(piperidin-4-ylmethyl)cycloheptan-1-amine
CID 79715542
N-ethyl-N-(pyrrolidin-3-ylmethyl)cyclohexanamine
CID 56831738
N-ethyl-N-[[(3S)-pyrrolidin-3-yl]methyl]cyclohexanamine
CID 86323570
N-ethyl-2,3-dimethyl-N-(piperidin-4-ylmethyl)cyclohexan-1-amine
CID 79715470
N-ethyl-1-methyl-N-(piperidin-4-ylmethyl)azepan-4-amine
CID 79715823
3-[[(1S)-cyclohex-2-en-1-yl]-(cyclopropylmethyl)amino]propanenitrile
CID 96525238
N-(piperidin-3-ylmethyl)-N-propan-2-ylcyclohex-2-en-1-amine
CID 106637323
N-butyl-N-(pyrrolidin-2-ylmethyl)cyclohex-2-en-1-amine
CID 106616594
N-ethyl-N-(pyrrolidin-3-ylmethyl)cyclopropanamine
CID 62372474
4-[ethyl(piperidin-4-ylmethyl)amino]-1,1-dioxothiolan-3-ol
CID 79717139
N-ethyl-N-propan-2-ylcyclohex-2-en-1-amine
CID 130679433

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine?
The IUPAC name of N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine (CID 114620607) is N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine.
What is the SMILES notation for N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine?
The canonical SMILES for N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine is CCN(CC1CCNCC1)C1C=CCCC1.
What is the InChIKey of N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine?
The InChIKey is YTUIOPGAPIBLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-2-16(14-6-4-3-5-7-14)12-13-8-10-15-11-9-13/h4,6,13-15H,2-3,5,7-12H2,1H3.
What are the key properties of N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine?
N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine has a molecular weight of 222.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(piperidin-4-ylmethyl)cyclohex-2-en-1-amine is sourced from PubChem (CID 114620607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).