1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine

C17H34N2 — CID 63250850

IUPAC1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine
SMILESCNCC1CCN(C2CCCCC2C(C)(C)C)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)15-7-5-6-8-16(15)19-11-9-14(10-12-19)13-18-4/h14-16,18H,5-13H2,1-4H3
InChIKeyCIZGFIWXFJZLQO-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds3

About 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine

1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine (PubChem CID 63250850) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine
PubChem CID63250850
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine
SMILESCNCC1CCN(C2CCCCC2C(C)(C)C)CC1
InChIInChI=1S/C17H34N2/c1-17(2,3)15-7-5-6-8-16(15)19-11-9-14(10-12-19)13-18-4/h14-16,18H,5-13H2,1-4H3
InChIKeyCIZGFIWXFJZLQO-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-tert-butylcyclohexyl)-N-(cyclopropylmethyl)piperidin-4-amine
CID 115306973
1-[1-(2-methoxycyclohexyl)piperidin-4-yl]-N-methylmethanamine
CID 106873246
3-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]propanoic acid
CID 65062639
2-[3-(methylaminomethyl)pyrrolidin-1-yl]cyclohexan-1-ol
CID 63267923
1-[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]-N-methylmethanamine
CID 129375491
2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]cyclohexan-1-ol
CID 55256824
N-[(4-tert-butylcyclohexyl)methyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 104574898
1-cyclopentyl-N-methylmethanamine;molecular hydrogen
CID 142969533
N-methyl-4-(methylaminomethyl)piperidin-1-amine
CID 123789266
2-[4-[(2-methylpropylamino)methyl]piperidin-1-yl]cyclohexan-1-ol
CID 55257021
N-methyl-1-[2-(4-propylazepan-1-yl)cyclobutyl]methanamine
CID 81005490
1-[1-(9H-fluoren-9-yl)pyrrolidin-3-yl]-N-methylmethanamine
CID 63263215

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine (CID 63250850) is 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine is CNCC1CCN(C2CCCCC2C(C)(C)C)CC1.
What is the InChIKey of 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine?
The InChIKey is CIZGFIWXFJZLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-17(2,3)15-7-5-6-8-16(15)19-11-9-14(10-12-19)13-18-4/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine?
1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-tert-butylcyclohexyl)piperidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 63250850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).